SCHEMBL6743691

SCHEMBL6743691

O=C1Cc2ccc(-c3ccc(Cl)s3)cc2N1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.55
CMA1 P23946 2/20 0.55
CRBN Q96SW2 3/20 0.47
EIF2AK2 P19525 1/20 0.46
PGR P06401 4/20 0.46
TDP2 O95551 1/20 0.42
PDK2 Q15119 1/20 0.41
HSD17B1 P14061 1/20 0.41
KDM1A O60341 1/20 0.41
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
CTSC P53634 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
MGLL Q99685 1/20 0.39

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
SCHEMBL16090265 0.82 CRBN (0.52) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL6743185 0.82 CRBN (0.50) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL5873746 0.76 SLC6A11 (0.52) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL4476035 0.75 AHR (0.67) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL6746640 0.75 AHR (0.49) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL6742551 0.73 CRBN (0.50) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL10711869 0.73 PGR (0.78) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL4408889 0.73 TDP2 (0.65) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL29908519 0.72 AHR (1.00) AHRCMA1CRBNEIF2AK2PGR
SCHEMBL221280 0.72 AHR (1.00) AHRCMA1CRBNEIF2AK2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6689806-B1 MODULATING PROTEIN KINASES AND RELATED SIGNAL TRANSDUCTION PATHWAYS SUGEN, INC. 2004-02-10 US disclosed
EP-1165513-A1 INDOLINONE COMPOUNDS AS KINASE INHIBITORS Sugen, Inc. (US) 2002-01-02 EP disclosed
WO-2000056709-A1 INDOLINONE COMPOUNDS AS KINASE INHIBITORS SUGEN, INC. (US) 2000-09-28 WO disclosed