SCHEMBL23863650

SCHEMBL23863650

C=CC(=O)NCCCCn1ccc2c(C(O)NCc3c(CCC)cc(C)[nH]c3=O)cc(-c3ccc(N4CCN(C)CC4)nc3)cc21

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 13/20 0.55
▸ EZH1 Q92800 10/20 0.55
▸ EED O75530 4/20 0.55
▸ SUZ12 Q15022 4/20 0.55
▸ RBBP4 Q09028 3/20 0.55
▸ AEBP2 Q6ZN18 3/20 0.55
▸ PRMT3 O60678 2/20 0.55
▸ RBBP7 Q16576 2/20 0.55
▸ SETD7 Q8WTS6 2/20 0.55
▸ ADRA1B P35368 1/20 0.47

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
SCHEMBL17734378 0.89 EZH2 (0.67) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL17734424 0.87 EZH2 (0.67) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL24227145 0.80 EZH2 (0.58) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL17734425 0.78 EZH2 (0.70) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL24227161 0.78 EZH2 (0.70) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL18864299 0.77 EZH1 (0.64) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL17734379 0.77 EZH2 (0.72) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL17734364 0.76 EZH2 (0.72) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL20991983 0.75 EZH1 (0.70) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16899422 0.74 EZH2 (0.68) 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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