SCHEMBL9054176

SCHEMBL9054176

Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCCCc4sccc43)cn2)c1C

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 15/20 0.64
AVPR1B P47901 11/20 0.64
AVPR2 P30518 10/20 0.53
OXTR P30559 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
SCHEMBL6989132 0.86 AVPR1A (0.85) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL6989377 0.85 AVPR1A (0.55) AVPR1AAVPR1BAVPR2
SCHEMBL6988392 0.84 AVPR1A (0.64) AVPR1AAVPR1BAVPR2
SCHEMBL6986830 0.84 AVPR1A (0.75) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL6993483 0.81 AVPR1A (0.56) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL6989046 0.78 AVPR1A (1.00) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL8796584 0.76 AVPR1A (0.61) AVPR1AAVPR1BAVPR2
SCHEMBL5234431 0.74 AVPR2 (0.65) AVPR1AAVPR2
SCHEMBL6993534 0.73 AVPR1A (0.71) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL8797250 0.73 AVPR1A (0.80) AVPR1AAVPR1BAVPR2OXTR

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
JP-8143565-A None JP disclosed
JP-H08143565-A BENZAMIDE COMPOUND FUJISAWA PHARMACEUT CO LTD 1996-06-04 JP disclosed