SCHEMBL6942774

SCHEMBL6942774

CCCCOC(C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1)(c1ccccc1)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 6/20 0.58
▸ DRD4 P21917 2/20 0.52
▸ CHRM2 P08172 3/20 0.51
▸ CHRM1 P11229 3/20 0.51
▸ CHRM3 P20309 3/20 0.51
▸ MCHR1 Q99705 1/20 0.50
▸ CACNA1G O43497 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ACHE P22303 1/20 0.49

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 0.94 CHRM2 (0.54) SIGMAR1CHRM2CHRM1CHRM3ALDH1A1
SCHEMBL6950046 0.84 CHRM2 (0.58) SIGMAR1DRD4CHRM2CHRM1CHRM3
SCHEMBL5862230 0.74 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9872559 0.74 DRD4 (0.78) SIGMAR1DRD4MCHR1SMN1; SMN2MEN1
SCHEMBL7470441 0.74 CHRM2 (0.83) CHRM2CHRM1CHRM3
SCHEMBL27502405 0.74 CHRM2 (0.83) CHRM2CHRM1CHRM3
SCHEMBL6952267 0.73 CHRM2 (0.65) SIGMAR1DRD4CHRM2CHRM1CHRM3
SCHEMBL9727102 0.72 SIGMAR1 (0.72) SIGMAR1DRD4MCHR1ALDH1A1SMN1; SMN2
SCHEMBL7475783 0.72 SIGMAR1 (0.65) SIGMAR1DRD4MCHR1ALDH1A1SMN1; SMN2
SCHEMBL6550863 0.72 SIGMAR1 (0.60) SIGMAR1DRD4SMN1; SMN2KMT2A

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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