SCHEMBL7911544

SCHEMBL7911544

COC(=O)Cc1nc(-c2ccc(OCc3ccccc3)cc2)oc1C

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.59
PPARG P37231 5/20 0.58
PPARA Q07869 5/20 0.58
MAPT P10636 7/20 0.57
KDM4E B2RXH2 1/20 0.55
TP53 P04637 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
KDR P35968 1/20 0.53
POLB P06746 1/20 0.52

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
SCHEMBL3590532 0.90 KDM4E (0.70) FFAR1PPARGPPARAMAPTKDM4E
SCHEMBL4034286 0.89 FFAR1 (0.69) FFAR1PPARGPPARAMAPTTP53
SCHEMBL6156630 0.87 FFAR1 (0.71) FFAR1PPARGPPARAMAPTKDM4E
SCHEMBL4893515 0.86 KDM4E (0.70) FFAR1PPARGPPARAMAPTKDM4E
SCHEMBL2930640 0.86 KDM4E (0.74) FFAR1PPARGPPARAMAPTKDM4E
SCHEMBL6607518 0.83 LMNA (0.60) MAPTKDM4ETP53SMN1; SMN2POLB
SCHEMBL5105247 0.83 PPARG (0.70) FFAR1PPARGPPARAMAPTTP53
SCHEMBL4032172 0.83 FFAR1 (0.58) FFAR1PPARGPPARAMAPTTP53
SCHEMBL3531377 0.82 KDM4E (0.61) FFAR1PPARGPPARAMAPTKDM4E
SCHEMBL4032011 0.82 FFAR1 (0.70) FFAR1PPARGPPARAMAPTTP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1083888-A1 MULTIBINDING AGENTS THAT MODULATE PPARgamma AND RXR RECEPTORS Advanced Medicine, Inc. (US) 2001-03-21 EP disclosed
WO-1999063983-A9 MULTIBINDING AGENTS THAT MODULATE PPARη AND RXR RECEPTORS ADVANCED MEDICINE INC (US) 2000-03-23 WO disclosed
WO-1999063983-A1 MULTIBINDING AGENTS THAT MODULATE PPARη AND RXR RECEPTORS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed