SCHEMBL168261

SCHEMBL168261

CCCCCCCCCCOc1ccc(COC=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.57
TP53 P04637 2/20 0.51
TSHR P16473 1/20 0.51
PLA2G4B P0C869 3/20 0.50
LTA4H P09960 1/20 0.50
S1PR2 O95136 2/20 0.49
S1PR1 P21453 2/20 0.49
S1PR3 Q99500 2/20 0.49
LPAR2 Q9HBW0 2/20 0.49
MMP2 P08253 1/20 0.49
MMP3 P08254 1/20 0.49
MMP9 P14780 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HPGD P15428 1/20 0.48
RARB P10826 3/20 0.48

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
SCHEMBL27615194 1.00 NR5A1 (0.57) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL2090024 0.95 SMN1; SMN2 (0.51) NR5A1TSHRLTA4HHPGD
SCHEMBL9249956 0.88 LMNA (0.50) TSHRLTA4HHPGD
SCHEMBL13300969 0.82 NR5A1 (0.54) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL7003380 0.82 GGPS1 (0.55) TSHRPLA2G4B
SCHEMBL16667814 0.81 ESR1 (0.56) TP53
SCHEMBL6872219 0.81 NR5A1 (0.58) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL9270936 0.81 NR5A1 (0.58) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL15018829 0.81 NR5A1 (0.58) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL1667493 0.81 NR5A1 (0.58) NR5A1TP53TSHRPLA2G4BLTA4H

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 1001 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2788353-B1 CAGE AMINE LIGANDS FOR METALLO-RADIOPHARMACEUTICALS Clarity Pharmaceuticals Ltd (AU) 2022-05-18 EP claimed
EP-2098508-B1 Processes for preparing cyclic derivatives which are modulators of chemokine receptor activity BRISTOL MYERS SQUIBB CO (US) 2012-06-20 EP claimed
US-7432389-B2 Compounds for the treatment of Alzheimer's disease ELAN PHARMACEUTICALS, INC. (US) 2008-10-07 US claimed
US-20060287306-A1 Compounds to treat alzheimer's disease ELAN PHARMACEUTICALS, INC. 2006-12-21 US claimed
US-20060276642-A1 Compounds to treat Alzheimer's disease ELAN PHARMACEUTICALS, INC. 2006-12-07 US claimed
US-20060211860-A1 Compounds for the treatment of Alzheimer's disease ELAN PHARMACEUTICALS, INC. 2006-09-21 US claimed
EP-1666452-A2 Compounds to treat Alzheimer's disease Elan Pharmaceuticals, Inc. (US) 2006-06-07 EP claimed
US-7030239-B2 Compounds to treat Alzheimer's disease ELAN PHARMACEUTICALS, INC. (US) 2006-04-18 US claimed
EP-1299352-B1 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARM INC (US) 2005-12-28 EP claimed
US-20040214846-A1 Compounds to treat Alzheimer's disease ELAN PHARMACEUTICALS, INC. 2004-10-28 US claimed
US-20030013881-A1 Compounds to treat Alzheimer's disease ELAN PHARMACEUTICALS, INC. 2003-01-16 US claimed
EP-1265849-A2 COMPOUNDS AND METHODS TO TREAT ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2002-12-18 EP claimed
US-20020128255-A1 Compounds to treat alzheimer's disease PHARMACIA & UPJOHN COMPANY 2002-09-12 US claimed
US-20020022623-A1 Compounds to treat alzheimer's disease ELAN PHARMACEUTICALS, INC. 2002-02-21 US claimed
US-20020016320-A1 Compounds to treat alzheimer's disease ELAN PHARMACEUTICALS, INC. 2002-02-07 US claimed
WO-2002002506-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed
WO-2002002512-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed
WO-2001070672-A2 COMPOUNDS AND METHODS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2001-09-27 WO claimed
US-5530124-A Method for preparing cyclic ureas and their use for the synthesis of HIV protease inhibitors THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1996-06-25 US claimed
US-4826993-A Substituted diazolidinones ELI LILLY AND COMPANY (US) 1989-05-02 US claimed

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

For each of this compound's patents that has machine-readable text (8 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-20040214846-A1 Compounds to treat Alzheimer's disease PSEN1, PSEN2, BACE1 NR5A1 256/4885TP53 2898/4885TSHR 4555/4885
US-20060276642-A1 Compounds to treat Alzheimer's disease PSEN2, PSEN1, BCHE NR5A1 567/4885TP53 2524/4885TSHR 4315/4885
US-20020128255-A1 Compounds to treat alzheimer's disease PSEN2, PSEN1, APP NR5A1 869/4885TP53 4138/4885TSHR 3725/4885
US-20060287306-A1 Compounds to treat alzheimer's disease PSEN2, PSEN1, APP NR5A1 866/4885TP53 2275/4885TSHR 3979/4885
US-20030013881-A1 Compounds to treat Alzheimer's disease PSEN2, PSEN1, BACE1 NR5A1 565/4885TP53 2584/4885TSHR 4246/4885
US-20020016320-A1 Compounds to treat alzheimer's disease PSEN1, PSEN2, CHAT NR5A1 616/4885TP53 3552/4885TSHR 3899/4885
US-20020022623-A1 Compounds to treat alzheimer's disease PSEN1, PSEN2, BACE1 NR5A1 256/4885TP53 2898/4885TSHR 4555/4885
US-20060211860-A1 Compounds for the treatment of Alzheimer's disease PSEN2, PSEN1, CHAT NR5A1 1100/4885TP53 3513/4885TSHR 3119/4885

“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.