SCHEMBL2647098

SCHEMBL2647098

Clc1ccc(-c2nc(-c3cccc(Oc4ccccc4)c3)c(-c3ccncc3)[nH]2)cc1Cl

nearest known ligand 0.80

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.80
MAPK13 O15264 14/20 0.80
MAPK12 P53778 14/20 0.80
MAPK11 Q15759 14/20 0.80
GCGR P47871 4/20 0.80
RAF1 P04049 10/20 0.77
BRAF P15056 5/20 0.64
BRDT Q58F21 1/20 0.55
MAPK9 P45984 1/20 0.54

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
SCHEMBL2647825 0.89 MAPK13 (1.00) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2648004 0.89 MAPK14 (0.83) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2648666 0.89 MAPK13 (0.87) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL28403334 0.87 MAPK13 (1.00) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2649589 0.87 MAPK13 (0.90) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2647680 0.84 MAPK14 (0.73) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2650067 0.84 MAPK13 (0.80) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2649049 0.84 MAPK14 (0.78) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2650287 0.84 MAPK13 (0.80) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL2650500 0.84 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11GCGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0959886-A4 TRIARYL SUBSTITUTED IMIDAZOLES AS GLUCAGON ANTAGONISTS MERCK & CO INC (US) 2001-05-02 EP claimed
EP-0959886-A1 TRIARYL SUBSTITUTED IMIDAZOLES AS GLUCAGON ANTAGONISTS Merck & Co., Inc. (US) 1999-12-01 EP claimed
US-5880139-A TREATING DIABETES, OBESITY, HYPERTENSION, CACHEXIA MERCK & CO., INC. (US) 1999-03-09 US claimed
WO-1998022109-A1 TRIARYL SUBSTITUTED IMIDAZOLES AS GLUCAGON ANTAGONISTS MERCK & CO., INC. (US) 1998-05-28 WO claimed
EP-0959886-A4 TRIARYL SUBSTITUTED IMIDAZOLES AS GLUCAGON ANTAGONISTS MERCK & CO INC (US) 2001-05-02 EP disclosed
EP-0959886-A1 TRIARYL SUBSTITUTED IMIDAZOLES AS GLUCAGON ANTAGONISTS Merck & Co., Inc. (US) 1999-12-01 EP disclosed
US-5880139-A TREATING DIABETES, OBESITY, HYPERTENSION, CACHEXIA MERCK & CO., INC. (US) 1999-03-09 US disclosed
WO-1998022109-A1 TRIARYL SUBSTITUTED IMIDAZOLES AS GLUCAGON ANTAGONISTS MERCK & CO., INC. (US) 1998-05-28 WO disclosed