SCHEMBL6847845

SCHEMBL6847845

O=C1Cc2ccc(-c3ncc[nH]3)cc2N1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.49
AHR P35869 3/20 0.47
CMA1 P23946 2/20 0.47
CRBN Q96SW2 4/20 0.47
PDE3B Q13370 2/20 0.47
PDE3A Q14432 2/20 0.47
EIF2AK2 P19525 1/20 0.46
NISCH Q9Y2I1 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
S1PR1 P21453 1/20 0.41
PDK2 Q15119 1/20 0.41
MTOR P42345 1/20 0.41
ADK P55263 1/20 0.41
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
MET P08581 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
SCHEMBL6741494 0.77 CRBN (0.54) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL29899623 0.77 KDM1A (0.55) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL6744849 0.77 KDM1A (0.55) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL29850050 0.76 PDE3B (0.76) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL6744175 0.76 PDE3B (0.76) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL6742260 0.75 KDM1A (0.54) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL23143575 0.73 PDE3B (0.54) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL23143561 0.73 PDE3B (0.54) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL29899581 0.73 PDE3B (0.54) KDM1AAHRCMA1CRBNPDE3B
SCHEMBL23143591 0.73 CMA1 (0.55) KDM1AAHRCMA1CRBNPDE3B

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