SCHEMBL11117905

SCHEMBL11117905

CCOC(=O)C1(C(N)c2ccccc2)CCNCC1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.58
KCNA3 P22001 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
OPRD1 P41143 3/20 0.41
OPRK1 P41145 3/20 0.41
SLC6A4 P31645 3/20 0.41
SLC22A1 O15245 1/20 0.41
ADRA1A P35348 1/20 0.41
KCNH2 Q12809 1/20 0.41
SLC6A2 P23975 3/20 0.41
SLC6A3 Q01959 3/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
TSHR P16473 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
SCHEMBL11118382 0.82 OPRM1 (0.55) OPRM1KCNA3SMN1; SMN2OPRD1OPRK1
SCHEMBL15601041 0.77 MEN1 (0.49) OPRM1SMN1; SMN2OPRK1CYP3A4CYP2C19
SCHEMBL5682210 0.76 KCNA3 (0.49) OPRM1KCNA3SMN1; SMN2OPRD1OPRK1
SCHEMBL8561734 0.74 OPRM1 (0.49) OPRM1SMN1; SMN2OPRD1OPRK1SLC6A4
SCHEMBL5678119 0.73 SMN1; SMN2 (0.50) OPRM1KCNA3SMN1; SMN2OPRD1OPRK1
Normeperidine SCHEMBL341796 0.73 OPRM1 (1.00) OPRM1OPRD1OPRK1SLC6A4SLC22A1
Normeperidine SCHEMBL4537496 0.72 OPRM1 (0.97) OPRM1OPRD1OPRK1SLC6A4SLC22A1
Normeperidine SCHEMBL4540908 0.72 OPRM1 (0.97) OPRM1OPRD1OPRK1SLC6A4SLC22A1
Normeperidine SCHEMBL8177568 0.72 OPRM1 (0.97) OPRM1OPRD1OPRK1SLC6A4SLC22A1
SCHEMBL21867155 0.72 OPRM1 (0.48) OPRM1SMN1; SMN2OPRD1OPRK1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0121972-A2 N-aryl-alpha-amino-carboxamides JANSSEN PHARMACEUTICA N.V. (BE) 1984-10-17 EP disclosed