SCHEMBL6746665

SCHEMBL6746665

O=C1Nc2cccc(CCO)c2C1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.44
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CREBBP Q92793 1/20 0.41
GFER P55789 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
HDAC8 Q9BY41 2/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
IDO1 P14902 3/20 0.37
TDO2 P48775 2/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL6745220 0.88 GSK3B (0.41) GSK3BMAPTKDM4EGAAL3MBTL1
SCHEMBL5733322 0.80 GSK3B (0.48) GSK3BMAPTKDM4EGAAL3MBTL1
SCHEMBL6744080 0.78 POLB (0.33) GSK3BMAPTKDM4ECREBBPALDH1A1
SCHEMBL17070929 0.76 GSK3B (0.58) GSK3BMAPTKDM4EGAAL3MBTL1
SCHEMBL5733348 0.74 SIRT2 (0.46) GSK3BMAPTKDM4EGAAL3MBTL1
SCHEMBL7825637 0.71 GSK3B (0.77) GSK3BMAPTKDM4EGAAL3MBTL1
SCHEMBL320007 0.67 HSD17B10 (0.53) GSK3BMAPTKDM4EGAAL3MBTL1
SCHEMBL154311 0.66 DRD2 (0.61) GSK3BKDM4E
SCHEMBL10326494 0.65 KDM4E (0.58) GSK3BMAPTKDM4EGAACREBBP
SCHEMBL6037889 0.65 KDM4E (0.58) GSK3BMAPTKDM4EGAACREBBP

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