SCHEMBL11047233

SCHEMBL11047233

CCCCOC(=O)C1(c2ccc(F)cc2)CCC(=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.52
▸ ALDH1A1 P00352 3/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ PRCP P42785 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ CHRM1 P11229 1/20 0.41

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
SCHEMBL11045094 0.92 OPRM1 (0.54) OPRM1ALDH1A1MEN1KMT2AMAPT
SCHEMBL11050761 0.87 OPRM1 (0.67) OPRM1ALDH1A1
SCHEMBL4682851 0.80 OPRM1 (0.58) OPRM1ALDH1A1MEN1KMT2APRCP
SCHEMBL11047897 0.79 OPRM1 (0.47) OPRM1ALDH1A1MEN1KMT2AMAPT
SCHEMBL348542 0.77 ALDH1A1 (0.49) OPRM1ALDH1A1MEN1KMT2ALMNA
SCHEMBL24220122 0.76 OPRM1 (0.76) OPRM1ALDH1A1
SCHEMBL7615416 0.76 MEN1 (0.58) OPRM1ALDH1A1MEN1KMT2AMAPT
SCHEMBL11800383 0.76 TSHR (0.39) OPRM1MEN1KMT2A
SCHEMBL11287102 0.74 HSD11B1 (0.40) OPRM1ALDH1A1MEN1KMT2AMAPT
SCHEMBL18500642 0.73 ALDH1A1 (0.41) ALDH1A1LMNASMN1; SMN2L3MBTL1

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-0035902-B1 1-(4-ARYL-CYCLOHEXYL)PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1984-10-31 — — EP disclosed
US-4329353-A ANTIEMETIC AND NEUROLEPTIC AGENTS JANSSEN PHARMACEUTICA, N.V. (BE) 1982-05-11 — — US disclosed
EP-0035902-A1 1-(4-Aryl-cyclohexyl)piperidine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1981-09-16 — — EP disclosed
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