SCHEMBL18864299

SCHEMBL18864299

CCCc1cc(C)[nH]c(=O)c1CNC(O)c1cc(-c2ccc(N3CCNCC3)nc2)cc2c1ccn2C(C)C

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH1 Q92800 9/20 0.64
▸ EZH2 Q15910 13/20 0.62
▸ PRMT3 O60678 1/20 0.56
▸ EED O75530 1/20 0.56
▸ RBBP4 Q09028 1/20 0.56
▸ SUZ12 Q15022 1/20 0.56
▸ RBBP7 Q16576 1/20 0.56
▸ AEBP2 Q6ZN18 1/20 0.56
▸ SETD7 Q8WTS6 1/20 0.56

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
SCHEMBL19620816 0.88 EZH2 (0.48) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL2594803 0.86 EZH1 (0.82) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL20991983 0.84 EZH1 (0.70) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL2592678 0.79 EZH2 (0.81) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL20992055 0.79 EZH2 (0.81) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL30956686 0.79 EZH2 (0.81) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL24227145 0.79 EZH2 (0.58) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL23863738 0.79 EZH2 (0.72) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL12180173 0.78 EZH2 (0.86) EZH1EZH2PRMT3EEDRBBP4
SCHEMBL2591377 0.78 EZH1 (1.00) EZH1EZH2PRMT3EEDRBBP4

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
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 — — US disclosed
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