SCHEMBL10916832

SCHEMBL10916832

O=C(c1ccc(F)cc1)c1[nH]c(=O)[nH]c1CN1CCC(O)(c2ccc(Cl)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 14/20 0.57
▸ DRD3 P35462 7/20 0.55
▸ HTR1A P08908 5/20 0.55
▸ HTR2A P28223 5/20 0.55
▸ HRH1 P35367 5/20 0.55
▸ DRD4 P21917 4/20 0.55
▸ DRD1 P21728 4/20 0.55
▸ DRD5 P21918 4/20 0.55
▸ SLC6A2 P23975 4/20 0.55
▸ SLC6A4 P31645 4/20 0.55
▸ HTR7 P34969 4/20 0.55
▸ HTR2B P41595 4/20 0.55
▸ ADRA2A P08913 2/20 0.55
▸ ADRA2B P18089 2/20 0.55
▸ ADRA2C P18825 2/20 0.55
▸ HTR2C P28335 2/20 0.55
▸ ADRA1A P35348 2/20 0.55
▸ ADRA1B P35368 2/20 0.55
▸ SLC6A3 Q01959 2/20 0.55
▸ MEN1 O00255 1/20 0.55

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
Hydrochloric Acid SCHEMBL10916751 0.99 DRD2 (0.56) DRD2DRD3HTR1AHTR2AHRH1
Hydrochloric Acid SCHEMBL10914753 0.89 DRD2 (0.54) DRD2DRD3HTR1AHTR2AHRH1
SCHEMBL10970466 0.84 CCR3 (0.56) DRD2DRD3HTR1AHTR2ADRD4
Hydrochloric Acid SCHEMBL10918932 0.83 OPRM1 (0.52) DRD2DRD3DRD4OPRM1
Hydrochloric Acid SCHEMBL10920703 0.81 OPRL1 (0.61) DRD2DRD3DRD4ABCB11CHRM4
SCHEMBL10972939 0.79 DRD2 (0.48) DRD2DRD3DRD4
Hydrochloric Acid SCHEMBL10967545 0.78 DRD2 (0.48) DRD2DRD3DRD4OPRM1
SCHEMBL10916090 0.77 DRD2 (0.50) DRD2DRD3DRD4MEN1CYP2D6
Hydrochloric Acid SCHEMBL10917172 0.77 SIGMAR1 (0.57) DRD2PMP22SIGMAR1
Hydrochloric Acid SCHEMBL10919520 0.77 OPRM1 (0.39) DRD2DRD3HTR7OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0064707-B1 4-(4-PHENYL-1-PIPERIDINYL)METHYL-5-ACYL-1,3-DIHYDRO-2H-IMIDAZOL-2-ONES MERRELL DOW PHARMACEUTICALS INC. (US) 1986-07-23 — — EP claimed
EP-0064707-A1 4-(4-Phenyl-1-piperidinyl)methyl-5-acyl-1,3-dihydro-2H-imidazol-2-ones MERRELL DOW PHARMACEUTICALS INC. (US) 1982-11-17 — — EP claimed
US-4329471-A CARDIOTONICS, HYPOTENSIVE AGENTS, AND ANTITHROMBOTIC AGENTS MERRELL DOW PHARMACEUTICALS INC. (US) 1982-05-11 — — US claimed
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