SCHEMBL23660784

SCHEMBL23660784

NC1(c2cccc(O)c2)CCNCC1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.42
OPRM1 P35372 3/20 0.42

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
SCHEMBL20201971 0.87 OPRD1 (0.49) OPRD1
SCHEMBL15021523 0.83 OPRD1 (0.46) OPRD1
SCHEMBL6681808 0.80 DRD2 (0.50) OPRD1OPRM1
SCHEMBL6601890 0.79 OPRD1 (0.63) OPRD1OPRM1
SCHEMBL31158384 0.79 SLC6A4 (0.46) OPRM1
SCHEMBL23647415 0.79 SLC6A4 (0.46) OPRM1
Hydrochloric Acid SCHEMBL31690834 0.79 DRD2 (0.49) OPRD1OPRM1
Hydrochloric Acid SCHEMBL2585702 0.77 OPRD1 (0.41) OPRD1OPRM1
SCHEMBL11125188 0.77 MEN1 (0.43) OPRD1OPRM1
SCHEMBL6665897 0.77 OPRM1 (0.44) OPRD1OPRM1

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
WO-2021143680-A1 HETEROARYL DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 浙江海正药业股份有限公司 2021-07-22 WO disclosed