SCHEMBL6946455

SCHEMBL6946455

CCCCOC(C(=O)NC1CCNCC1)(c1ccccc1)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SSTR1 P30872 1/20 0.47
▸ SSTR4 P31391 1/20 0.47
▸ CHRM2 P08172 2/20 0.44
▸ CHRM1 P11229 2/20 0.44
▸ CHRM3 P20309 2/20 0.44
▸ ACSS2 Q9NR19 1/20 0.40
▸ GNAI3 P08754 1/20 0.39
▸ GNAO1 P09471 1/20 0.39
▸ GNAI1 P63096 1/20 0.39
▸ ITGB3 P05106 9/20 0.39
▸ ITGA2B P08514 9/20 0.39
▸ EPHX1 P07099 1/20 0.39
▸ ITGAV P06756 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ CCR1 P32246 1/20 0.38
▸ HTR4 Q13639 1/20 0.38

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
SCHEMBL6953811 0.84 CHRM2 (0.54) CHRM2CHRM1CHRM3
SCHEMBL6942774 0.80 SIGMAR1 (0.58) CHRM2CHRM1CHRM3
SCHEMBL27510805 0.74 SCN5A (0.41) CHRM2CHRM1CHRM3CYP3A4
SCHEMBL27934941 0.73 CHRM1 (0.51) SSTR1SSTR4CHRM2CHRM1CHRM3
SCHEMBL6950046 0.72 CHRM2 (0.58) CHRM2CHRM1CHRM3
SCHEMBL27787058 0.71 CHRM2 (0.54) SSTR1SSTR4CHRM2CHRM1CHRM3
SCHEMBL6945434 0.70 CCR1 (0.38) CHRM2CHRM1CHRM3CYP3A4HPGD
SCHEMBL17294645 0.70 CHRM2 (0.56) SSTR1SSTR4CHRM2CHRM1CHRM3
SCHEMBL17294627 0.70 CHRM2 (0.58) SSTR1SSTR4CHRM2CHRM1CHRM3
SCHEMBL27787057 0.68 HPGD (0.77) CHRM1CHRM3EPHX1CYP3A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0913393-B1 Arylacetic amide derivative or salt thereof, and pharmaceutical comprising it SSP CO LTD (JP) 2003-02-12 — — EP disclosed
US-6060485-A UROGENITAL DISORDERS SSP CO., LTD. (JP) 2000-05-09 — — US disclosed
CN-1222510-A Arylacetic amide derivative or salt thereof, and pharmaceutical comprising it SSP CO LTD (JP) 1999-07-14 — — CN disclosed
EP-0913393-A2 Arylacetic amide derivative or salt thereof, and pharmaceutical comprising it SSP Co., Ltd. (JP) 1999-05-06 — — EP disclosed
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