SCHEMBL344082

SCHEMBL344082

CC(C)([C]=O)Oc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.53
CYP1A2 P05177 5/20 0.53
CYP3A4 P08684 5/20 0.53
CYP2C19 P33261 4/20 0.53
MAPT P10636 4/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
CYP2D6 P10635 2/20 0.53
PPARG P37231 3/20 0.46
ABCB11 O95342 2/20 0.46
TSHR P16473 2/20 0.46
HTR2A P28223 2/20 0.46
PMP22 Q01453 2/20 0.46
FABP2 P12104 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
ALDH1A1 P00352 4/20 0.41
CYP2C9 P11712 3/20 0.41
HPGD P15428 2/20 0.41
USP2 O75604 2/20 0.41
LMNA P02545 2/20 0.41

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
SCHEMBL5672815 0.88 PPARA (0.65) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL11283720 0.81 CA1 (0.48) CYP3A4MAPTALDH1A1MAPK1NPSR1
SCHEMBL2830535 0.79 PPARA (0.48) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL17186898 0.79 PPARA (0.48) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL3365142 0.78 CA4 (0.39) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL6212374 0.77 PPARA (0.49) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL8886588 0.76 NQO1 (0.54) CYP1A2MEN1KMT2ATSHRALDH1A1
SCHEMBL196705 0.75 PPARA (0.57) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL11641137 0.75 PPARA (0.44) PPARACYP1A2CYP3A4CYP2C19MAPT
SCHEMBL8886704 0.74 PPARA (0.46) PPARACYP1A2CYP3A4CYP2C19MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1512397-B1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES INST MED MOLECULAR DESIGN INC (JP) 2014-10-08 EP claimed
US-20100113770-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-05-06 US claimed
US-20050192269-A1 Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds THOMPSON RICHARD C (US) 2005-09-01 US claimed
US-20040106598-A1 Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting Beta-amyloid peptide release and/or its synthesis by use of such compounds THOMPSON RICHARD C (US) 2004-06-03 US claimed
EP-1089980-A1 COMPOUNDS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS Elan Pharmaceuticals, Inc. (US) 2001-04-11 EP claimed
WO-1999067221-A1 COMPOUNDS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS ELAN PHARMACEUTICALS, INC. (US) 1999-12-29 WO claimed
US-4118583-A ANTICOAGULANT, ANTICHOLINERGIC AGENTS LABORATORIES OM SOCIETE ANONYME (CH) 1978-10-03 US claimed
US-4060617-A Esters of the ophyllinylacetic acid Wulfing, Johann A. (DT) 1977-11-29 US claimed
US-10434076-B2 Use of 2,5-dihydroxybenzene derivatives for treating dermatitis AmDerma Pharmaceuticals, LLC (US) 2019-10-08 US disclosed
US-20190192474-A1 Use Of 2,5-Dihydroxybenzene Compounds And Derivatives For The Treatment Of Skin Cancer AmDerma Pharmaceuticals, LLC 2019-06-27 US disclosed
US-20190192473-A1 Use Of 2,5-Dihydroxybenzene Compounds And Derivatives For The Treatment Of Rosacea AmDerma Pharmaceuticals, LLC 2019-06-27 US disclosed
US-10278941-B2 Use of 2,5-dihydroxybenzene compounds and derivatives for the treatment of glioma AmDerma Pharmaceuticals, LLC (US) 2019-05-07 US disclosed
US-10278940-B2 Use of 2,5-dihydroxybenzene compounds and derivatives for the treatment of skin cancer AmDerma Pharmaceuticals, LLC (US) 2019-05-07 US disclosed
US-20180036265-A1 Use of 2,5-Dihydroxybenzene Derivatives for Treating Dermatitis ACTION MEDICINES, S.L. (ES) 2018-02-08 US disclosed
US-RE32581-E Certain substituted phenyl esters of nicotinic acid, compositions and methods of using same for treatment of hyperlipidemia MERZ + CO. GMBH & CO. (DE) 1988-01-19 US disclosed
US-4412998-A ANTILIPEMIC MERZ & COMPANY (DE) 1983-11-01 US disclosed
US-4321268-A Certain substituted phenyl esters of nicotinic acid, compositions and methods of using same MERZ & CO. (DE) 1982-03-23 US disclosed
US-4118583-A ANTICOAGULANT, ANTICHOLINERGIC AGENTS LABORATORIES OM SOCIETE ANONYME (CH) 1978-10-03 US disclosed
US-4060617-A Esters of the ophyllinylacetic acid Wulfing, Johann A. (DT) 1977-11-29 US disclosed
US-4060617-A Esters of the ophyllinylacetic acid Wulfing, Johann A. (DT) 1977-11-29 US 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 (9 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-20190192473-A1 Use Of 2,5-Dihydroxybenzene Compounds And Derivatives For The Treatment Of Rosacea CYP8B1, CYP1B1, CYP26B1 PPARA 957/4885CYP1A2 4/4885CYP3A4 163/4885
US-10278940-B2 Use of 2,5-dihydroxybenzene compounds and derivatives for the treatment of skin cancer CYP8B1, CYP26B1, CYP24A1 PPARA 2820/4885CYP1A2 52/4885CYP3A4 220/4885
US-10434076-B2 Use of 2,5-dihydroxybenzene derivatives for treating dermatitis CYP24A1, CYP8B1, CYP26B1 PPARA 1350/4885CYP1A2 46/4885CYP3A4 407/4885
US-20180036265-A1 Use of 2,5-Dihydroxybenzene Derivatives for Treating Dermatitis CYP24A1, CYP8B1, CYP26B1 PPARA 1350/4885CYP1A2 46/4885CYP3A4 407/4885
US-20100113770-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES RELA, NFKBIA, NFE2 PPARA 130/4885CYP1A2 855/4885CYP3A4 1664/4885
US-20040106598-A1 Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting Beta-amyloid peptide release and/or its synthesis by use of such compounds BACE1, APP, BACE2 PPARA 1886/4885CYP1A2 3381/4885CYP3A4 3317/4885
US-20190192474-A1 Use Of 2,5-Dihydroxybenzene Compounds And Derivatives For The Treatment Of Skin Cancer CYP8B1, CYP26B1, CYP24A1 PPARA 2820/4885CYP1A2 52/4885CYP3A4 220/4885
US-20050192269-A1 Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds BACE1, APP, BACE2 PPARA 1738/4885CYP1A2 3219/4885CYP3A4 3056/4885
US-10278941-B2 Use of 2,5-dihydroxybenzene compounds and derivatives for the treatment of glioma ALDH1A2, IDH3A, IDH3B PPARA 1634/4885CYP1A2 31/4885CYP3A4 303/4885

“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.