SCHEMBL1739063

SCHEMBL1739063

C=Cc1ccc(-c2nccc3c(C)c(C)n(CCC(C)C)c23)cc1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 3/20 0.38

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 SCHEMBL1736819 0.99 CACNA1B (0.38) CACNA1B
SCHEMBL1738709 0.87 CACNA1B (0.34) CACNA1B
SCHEMBL1739158 0.87 MCL1 (0.35) CACNA1B
Hydrochloric Acid SCHEMBL1737803 0.86 CACNA1B (0.33) CACNA1B
Hydrochloric Acid SCHEMBL1736609 0.86 MCL1 (0.34) CACNA1B
SCHEMBL1738848 0.85 TGFBR1 (0.36) CACNA1B
SCHEMBL1737532 0.85 TRPC5 (0.36) CACNA1B
SCHEMBL1737960 0.84 CACNA1B (0.35) CACNA1B
SCHEMBL1735909 0.84 MAPK14 (0.35) CACNA1B
Hydrochloric Acid SCHEMBL1736647 0.84 TRPC5 (0.36) CACNA1B

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