SCHEMBL1736299

SCHEMBL1736299

CSc1ccc(-c2nccc3c(C)c(C)n(CC4CC4)c23)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 4/20 0.35
MAPK12 P53778 4/20 0.35
MAPK11 Q15759 4/20 0.35
MAPK14 Q16539 4/20 0.35
EPHX2 P34913 1/20 0.32
SLC34A1 Q06495 1/20 0.32
MDM2 Q00987 1/20 0.30
MAPT P10636 1/20 0.30
GCGR P47871 2/20 0.30
KCNH2 Q12809 1/20 0.30
DYRK1A Q13627 1/20 0.30

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 SCHEMBL1736629 0.99 MAPK13 (0.34) MAPK13MAPK12MAPK11MAPK14EPHX2
SCHEMBL1737522 0.88 MAPK14 (0.45) MAPK13MAPK12MAPK11MAPK14SLC34A1
Hydrochloric Acid SCHEMBL1737777 0.87 MAPK14 (0.44) MAPK13MAPK12MAPK11MAPK14SLC34A1
SCHEMBL1737560 0.86 MAPK14 (0.44) MAPK13MAPK12MAPK11MAPK14SLC34A1
SCHEMBL1737149 0.86 MERTK (0.38) MAPK13MAPK12MAPK11MAPK14SLC34A1
SCHEMBL1737296 0.85 MERTK (0.38) MAPK13MAPK12MAPK11MAPK14MAPT
Hydrochloric Acid SCHEMBL1737022 0.85 MAPK14 (0.43) MAPK13MAPK12MAPK11MAPK14SLC34A1
Hydrochloric Acid SCHEMBL1736821 0.85 MERTK (0.37) MAPK13MAPK12MAPK11MAPK14SLC34A1
Hydrochloric Acid SCHEMBL1737406 0.84 MERTK (0.38) MAPK13MAPK12MAPK11MAPK14MDM2
SCHEMBL1739189 0.84 CYP17A1 (0.34) MAPK13MAPK12MAPK11MAPK14MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784404-B1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2011-11-16 EP claimed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US claimed