SCHEMBL19964844

SCHEMBL19964844

COc1cc(-c2cc3cc(C(=O)O)c(C)c(C(C)N4CCOCC4)n3c2)cc(OC)c1CN1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EED O75530 20/20 0.48
RBBP4 Q09028 20/20 0.48
SUZ12 Q15022 20/20 0.48
EZH2 Q15910 20/20 0.48
AEBP2 Q6ZN18 20/20 0.48

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
SCHEMBL19964854 0.91 EED (0.47) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21157295 0.88 EED (0.48) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21156564 0.86 EED (0.51) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21156126 0.85 EED (0.49) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21156530 0.84 EED (0.53) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL19964845 0.83 EED (0.74) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL28886627 0.83 EED (0.58) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113287 0.82 EED (0.52) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21156121 0.82 EED (0.52) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21156102 0.80 EED (0.53) EEDRBBP4SUZ12EZH2AEBP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018045971-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 上海海和药物研究开发有限公司 2018-03-15 WO disclosed