SCHEMBL3256699

SCHEMBL3256699

CN(CCc1cn(Cc2ccccc2Br)c2ccc(Br)cc12)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 12/20 0.43
▸ CNR2 P34972 1/20 0.38
▸ CYP19A1 P11511 2/20 0.38
▸ HTR2A P28223 1/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ FNTA P49354 1/20 0.35
▸ FNTB P49356 1/20 0.35

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
SCHEMBL3264614 0.87 HTR6 (0.54) HTR6CYP19A1TAAR1HDAC1HDAC10
SCHEMBL3252401 0.82 HTR6 (0.44) HTR6CYP19A1TAAR1FNTAFNTB
SCHEMBL3250179 0.77 HTR6 (0.58) HTR6CYP19A1TAAR1HDAC1HDAC10
SCHEMBL3257361 0.76 HTR6 (0.65) HTR6HTR2AHDAC1HDAC8HDAC6
SCHEMBL3251339 0.76 HTR6 (0.52) HTR6CYP19A1TAAR1HDAC1HDAC10
SCHEMBL3257594 0.76 HTR6 (0.60) HTR6TAAR1HDAC1HDAC10HDAC8
SCHEMBL4431649 0.76 HTR6 (0.52) HTR6CYP19A1
SCHEMBL3248439 0.75 HTR6 (0.51) HTR6CYP19A1
SCHEMBL3253620 0.74 HTR6 (0.69) HTR6CYP19A1TAAR1HDAC1HDAC10
SCHEMBL3256595 0.74 HTR6 (0.74) HTR6HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1537113-B9 ARYLALKYL INDOLES HAVING SEROTONIN RECEPTOR AFFINITY USEFUL AS THERAPEUTIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SUVEN LIFE SCIENCES LTD (IN) 2010-05-26 — — EP disclosed
EP-1537113-B1 ARYLALKYL INDOLES HAVING SEROTONIN RECEPTOR AFFINITY USEFUL AS THERAPEUTIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SUVEN LIFE SCIENCES LTD (IN) 2009-10-07 — — EP disclosed
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