SCHEMBL18155874

SCHEMBL18155874

CC1(I)CCN(CC(F)(F)F)C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
JAK1 P23458 1/20 0.30

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
SCHEMBL18202958 0.79 OPRD1 (0.36) OPRM1OPRD1OPRK1JAK1
SCHEMBL18199663 0.76 OPRM1 (0.32) OPRM1OPRD1OPRK1JAK1
SCHEMBL19323250 0.74 OPRM1 (0.34) OPRM1OPRD1OPRK1
SCHEMBL17287035 0.74
SCHEMBL12424458 0.74 OPRM1 (0.38) OPRM1OPRD1OPRK1JAK1
SCHEMBL18459249 0.73 OPRM1 (0.31) OPRM1OPRD1OPRK1
SCHEMBL31757571 0.72 TSHR (0.32) OPRM1OPRD1OPRK1
SCHEMBL24342357 0.72 OPRM1 (0.38) OPRM1OPRD1OPRK1JAK1
SCHEMBL26765864 0.72 OPRD1 (0.37) OPRD1OPRK1
SCHEMBL23514832 0.71 OPRM1 (0.39) OPRM1OPRD1OPRK1JAK1

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-3081569-A1 IMIDAZOLE DERIVATIVE USED AS ANTIVIRAL AGENT AND USE THEREOF IN PREPARATION OF MEDICAMENT Medshine Discovery Inc. (CN) 2016-10-19 EP disclosed