SCHEMBL1737073

SCHEMBL1737073

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

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.32
JAK2 O60674 1/20 0.31

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 SCHEMBL1738437 0.99 CACNA1B (0.32) CACNA1BJAK2
SCHEMBL1738894 0.88 MCL1 (0.34) JAK2
SCHEMBL1737486 0.88 CACNA1B (0.34) CACNA1B
Hydrochloric Acid SCHEMBL1736952 0.87 MCL1 (0.34) JAK2
Hydrochloric Acid SCHEMBL1736147 0.87 CACNA1B (0.34) CACNA1B
SCHEMBL1737685 0.86 PTGS1 (0.37) JAK2
SCHEMBL1737425 0.86 IDO1 (0.34) JAK2
SCHEMBL1737242 0.86 NQO2 (0.35) JAK2
Hydrochloric Acid SCHEMBL1736304 0.85 IDO1 (0.33) JAK2
Hydrochloric Acid SCHEMBL1736223 0.85 PTGS1 (0.36) JAK2

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