SCHEMBL1374530

SCHEMBL1374530

O=C(O)C1(c2ccc(-c3ccc(F)c(Cl)c3)c(F)c2)CC1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 11/20 0.85
CYP2C9 P11712 7/20 0.85
AKR1C3 P42330 6/20 0.85
AKR1C2 P52895 6/20 0.85
CYP2C19 P33261 6/20 0.85
CYP3A4 P08684 6/20 0.85
PSEN1 P49768 2/20 0.85
PSEN2 P49810 2/20 0.85
APH1B Q8WW43 2/20 0.85
NCSTN Q92542 2/20 0.85
APH1A Q96BI3 2/20 0.85
PSENEN Q9NZ42 2/20 0.85
AKR1C1 Q04828 3/20 0.76
AKR1B10 O60218 1/20 0.68
AKR1C4 P17516 1/20 0.68
CYP2D6 P10635 3/20 0.67
CYP1A2 P05177 1/20 0.53
PRKAB2 O43741 1/20 0.44
PRKAG1 P54619 1/20 0.44
PRKAA2 P54646 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3945554 0.95 AKR1C3 (0.85) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL29926966 0.92 APP (1.00) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL407631 0.92 APP (1.00) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL1371930 0.87 APP (0.82) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL1372754 0.86 AKR1C3 (1.00) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL2794766 0.85 AKR1C3 (0.64) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL5448540 0.83 APP (1.00) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL4990070 0.83 AKR1C3 (0.66) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL2777333 0.82 APP (1.00) APPCYP2C9AKR1C3AKR1C2CYP2C19
SCHEMBL1371366 0.82 APP (0.97) APPCYP2C9AKR1C3AKR1C2CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150065567-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND MULTIPLE SCLEROSIS CHIESI FARMACEUTICI S.P.A. (IT) 2015-03-05 US claimed
US-20130165505-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF COGNITIVE IMPAIRMENT CHIESI FARMACEUTICI S.P.A. (IT) 2013-06-27 US claimed
US-7662995-B2 1-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)cyclopropanecarboxylic acid, for example; treatment and/or prevention of Alzheimer's disease; inhibiting the release of A beta 42 peptide thereby being able to modulate gamma-secretase activity without affecting other important metabolic processes CHIESI FARMACEUTICI S.P.A. (IT) 2010-02-16 US claimed
WO-2006020850-A2 PHARMACEUTICAL COMPOSITION AND METHOD FOR TREATING NEURODEGENERATIVE DISORDERS MYRIAD GENETICS, INC. (US) 2006-02-23 WO claimed
WO-2006020852-A2 PHARMACEUTICAL COMPOSITION AND METHOD FOR TREATING NEURODEGENERATIVE DISORDERS MYRIAD GENETICS, INC. (US) 2006-02-23 WO claimed
WO-2006020853-A2 PHARMACEUTICAL COMPOSITION AND METHOD FOR TREATING NEURODEGENERATIVE DISORDERS MYRIAD GENETICS, INC. (US) 2006-02-23 WO claimed
US-9592210-B2 1-phenylalkanecarboxylic acid derivatives for the treatment of cognitive impairment CHIESI FARMACEUTICI S.P.A. (IT) 2017-03-14 US disclosed
WO-2015173133-A1 FORMULATIONS AND METHODS OF TREATING ALZHEIMER'S DISEASE AND OTHER PROTEINOPATHIES BY COMBINATION THERAPY CHIESI FARMACEUTICI S.P.A. (IT) 2015-11-19 WO disclosed
US-20150320706-A1 FORMULATIONS AND METHODS OF TREATING ALZHEIMER'S DISEASE AND OTHER PROTEINOPATHIES BY COMBINATION THERAPY CHIESI FARMACEUTICI S.P.A. (IT) 2015-11-12 US disclosed
US-20150065567-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND MULTIPLE SCLEROSIS CHIESI FARMACEUTICI S.P.A. (IT) 2015-03-05 US disclosed
US-20130165505-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF COGNITIVE IMPAIRMENT CHIESI FARMACEUTICI S.P.A. (IT) 2013-06-27 US disclosed
US-8314268-B2 1-phenylalkanecarboxylic acid derivatives for the treatment of neurodegenerative diseases CHIESI FARMACEUTICI S.P.A. (IT) 2012-11-20 US disclosed
US-20110288175-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES CHIESI FARMACEUTICI S.P.A. (IT) 2011-11-24 US disclosed
US-7662995-B2 1-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)cyclopropanecarboxylic acid, for example; treatment and/or prevention of Alzheimer's disease; inhibiting the release of A beta 42 peptide thereby being able to modulate gamma-secretase activity without affecting other important metabolic processes CHIESI FARMACEUTICI S.P.A. (IT) 2010-02-16 US disclosed
EP-1594833-B1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES CHIESI FARMA SPA (IT) 2008-09-24 EP disclosed
US-20070293538-A1 Pharmaceutical Composition And Methods For Treating Neurodegenerative Disorders MYRIAD GENETICS, INCORPORATED (US) 2007-12-20 US disclosed
US-20070060752-A1 1-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)cyclopropanecarboxylic acid, for example; treatment and/or prevention of Alzheimer's disease; inhibiting the release of A beta 42 peptide thereby being able to modulate gamma-secretase activity without affecting other important metabolic processes CHIESI FARMACEUTICI S.P.A. (IT) 2007-03-15 US disclosed
WO-2006001877-A2 COMBINATION TREATMENT FOR NEURODEGENERATIVE DISORDERS COMPRISING R-FLURBIPROFEN MYRIAD GENETICS, INC. (US) 2006-01-05 WO disclosed
EP-1594833-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES CHIESI FARMACEUTICI S.p.A. (IT) 2005-11-16 EP disclosed
WO-2004074232-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES CHIESI FARMACEUTICI S.P.A. (IT) 2004-09-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130165505-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF COGNITIVE IMPAIRMENT PSEN1, PSEN2, NAT1 APP 15/4885CYP2C9 1978/4885AKR1C3 505/4885
US-20150320706-A1 FORMULATIONS AND METHODS OF TREATING ALZHEIMER'S DISEASE AND OTHER PROTEINOPATHIES BY COMBINATION THERAPY MAPT, GABRA5, MAP1LC3A APP 6/4885CYP2C9 4477/4885AKR1C3 1077/4885
US-20070060752-A1 1-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)cyclopropanecarboxylic acid, for example; treatment and/or prevention of Alzheimer's disease; inhibiting the release of A beta 42 peptide thereby being able to modulate gamma-secretase activity without affecting other important metabolic processes BACE1, APP, BACE2 APP 2/4885CYP2C9 1801/4885AKR1C3 1458/4885
US-20070293538-A1 Pharmaceutical Composition And Methods For Treating Neurodegenerative Disorders GRN, NLN, PSEN1 APP 9/4885CYP2C9 556/4885AKR1C3 504/4885
US-20150065567-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND MULTIPLE SCLEROSIS PSEN1, APP, PSEN2 APP 2/4885CYP2C9 3448/4885AKR1C3 740/4885
US-20110288175-A1 1-PHENYLALKANECARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PSEN1, SNCA, PSEN2 APP 5/4885CYP2C9 3646/4885AKR1C3 703/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.