SCHEMBL23863744

SCHEMBL23863744

Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(N4CCN(C)CC4)nc3)cc3c2ccn3C(C)C)cn1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 14/20 0.56
▸ EZH1 Q92800 9/20 0.56
▸ EED O75530 4/20 0.56
▸ SUZ12 Q15022 4/20 0.56
▸ RBBP4 Q09028 3/20 0.56
▸ AEBP2 Q6ZN18 3/20 0.56
▸ RBBP7 Q16576 2/20 0.56
▸ PRMT3 O60678 1/20 0.54
▸ SETD7 Q8WTS6 1/20 0.54
▸ HDAC6 Q9UBN7 1/20 0.46

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
SCHEMBL16115800 0.85 EZH2 (0.58) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16116333 0.85 EZH2 (0.65) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2593962 0.83 EZH2 (0.80) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2595084 0.83 EZH1 (0.73) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL17734398 0.82 EZH2 (0.64) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL17734420 0.82 EZH2 (0.64) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115744 0.81 EZH2 (0.51) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115389 0.81 EZH1 (0.72) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2592678 0.81 EZH2 (0.81) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16116289 0.81 EZH2 (0.51) EZH2EZH1EEDSUZ12RBBP4

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
EP-3885343-A1 INDOLE COMPOUNDS AS EZH2 INHIBITORS AND USES THEREOF Dana-Farber Cancer Institute, Inc. (US) 2021-09-29 — — EP disclosed
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