SCHEMBL10968588

SCHEMBL10968588

NC(=O)c1[nH]c(=O)[nH]c1CN1CCC(c2ccc(Cl)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ DRD2 P14416 5/20 0.45
▸ HTR1A P08908 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ HTR7 P34969 1/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ CHRM4 P08173 1/20 0.42
▸ DRD4 P21917 3/20 0.42
▸ DRD3 P35462 3/20 0.42
▸ NR3C1 P04150 2/20 0.42
▸ PARP1 P09874 1/20 0.39
▸ CCR2 P41597 1/20 0.39
▸ GRM2 Q14416 1/20 0.39
▸ MCHR1 Q99705 1/20 0.39
▸ GRM5 P41594 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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 SCHEMBL10965609 0.87 ALDH1A1 (0.46) MEN1KMT2ADRD2HTR1AHTR7
SCHEMBL10915707 0.84 MEN1 (0.51) MEN1KMT2AHTR1AHTR2AHTR7
SCHEMBL10967335 0.78 KDM4E (0.48) MEN1KMT2ADRD2HTR1ADRD4
Hydrochloric Acid SCHEMBL10914569 0.75 ALDH1A1 (0.48) MEN1KMT2ADRD2HTR1AHTR7
Hydrochloric Acid SCHEMBL10971146 0.75 CCR5 (0.46) MEN1KMT2ADRD2CHRM4DRD4
Hydrochloric Acid SCHEMBL10915699 0.74 SIGMAR1 (0.49) MEN1KMT2ADRD2HTR1AHTR7
Hydrochloric Acid SCHEMBL10972048 0.74 KDM4E (0.47) MEN1KMT2ADRD2CHRM4NR3C1
Hydrochloric Acid SCHEMBL10970085 0.73 ALDH1A1 (0.46) MEN1KMT2ADRD2HTR7GAA
SCHEMBL10967209 0.73 POLB (0.50) MEN1KMT2ADRD2HTR2ADRD4
SCHEMBL10970591 0.72 ALDH1A1 (0.47) DRD2CHRM4SMN1; SMN2

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-0064706-B1 5-(4-PHENYL-1-PIPERIDINYL)METHYL-2,3-DIHYDRO-2-OXO-1H-IMIDAZOLE-4-CARBOXYLIC ACID DERIVATIVES MERRELL DOW PHARMACEUTICALS INC. (US) 1985-07-03 — — EP disclosed
EP-0064706-A1 5-(4-Phenyl-1-piperidinyl)methyl-2,3-dihydro-2-oxo-1H-imidazole-4-carboxylic acid derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1982-11-17 — — EP disclosed
US-4329470-A CORDIOTONIC, HYPOTENSIVE, ANTITHROMBOSIS MERRELL DOW PHARMACEUTICALS INC. (US) 1982-05-11 — — US disclosed
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