SCHEMBL6544205

SCHEMBL6544205

CC(Oc1ccc(CC2SC(=O)NC2=O)cc1)c1nc2ccc(Oc3cccnc3)cc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.42
FFAR1 O14842 3/20 0.42
PPARA Q07869 2/20 0.42
ESRRA P11474 1/20 0.40
THRA P10827 2/20 0.40
THRB P10828 2/20 0.40
MPC2 O95563 1/20 0.40
CYP2C8 P10632 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
Hydrochloric Acid SCHEMBL6544229 0.99 PPARG (0.42) PPARGFFAR1PPARAESRRATHRA
Hydrochloric Acid SCHEMBL6544449 0.90 PPARG (0.46) PPARGFFAR1PPARAESRRATHRA
Hydrochloric Acid SCHEMBL6543855 0.88 PPARG (0.46) PPARGFFAR1PPARAESRRATHRA
SCHEMBL6543774 0.88 KDR (0.45) PPARGFFAR1PPARAMPC2CYP2C8
SCHEMBL6543694 0.88 PPARG (0.46) PPARGFFAR1PPARAESRRATHRA
SCHEMBL6543635 0.88 PPARG (0.49) PPARGFFAR1PPARAESRRATHRA
Hydrochloric Acid SCHEMBL3240947 0.87 PPARG (0.45) PPARGFFAR1PPARAESRRATHRA
SCHEMBL6543708 0.87 FFAR1 (0.45) PPARGFFAR1PPARAESRRATHRA
SCHEMBL6544497 0.87 FFAR1 (0.49) PPARGFFAR1PPARAESRRATHRA
SCHEMBL6544249 0.87 MAPT (0.50) PPARGFFAR1PPARAESRRATHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1022272-B1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS SANKYO CO (JP) 2004-05-26 EP claimed
US-6432993-B1 BENZIMIDAZOLE OR IMIDAZO(4,5-B)PYRIDINE DERIVATES; IMMUNOMODULATORS; ALDOSE REDUCTASE AND LIPOXYGENASE INHIBITORS; DIABETES; PREVENTS LIPID PEROXIDATION; ANTILIPEMIC, HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 2002-08-13 US claimed
EP-1022272-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS Sankyo Company Limited (JP) 2000-07-26 EP claimed
EP-1022272-B1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS SANKYO CO (JP) 2004-05-26 EP disclosed
US-6432993-B1 BENZIMIDAZOLE OR IMIDAZO(4,5-B)PYRIDINE DERIVATES; IMMUNOMODULATORS; ALDOSE REDUCTASE AND LIPOXYGENASE INHIBITORS; DIABETES; PREVENTS LIPID PEROXIDATION; ANTILIPEMIC, HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 2002-08-13 US disclosed
EP-1022272-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS Sankyo Company Limited (JP) 2000-07-26 EP disclosed