SCHEMBL21753312

SCHEMBL21753312

O=C(O)N1CCC2(CC1)CN(c1ccc(F)cc1)C(=O)N2

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.51
ITGA2B P08514 2/20 0.51
OPRL1 P41146 18/20 0.44
OPRM1 P35372 15/20 0.44

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
SCHEMBL21753334 0.83 OPRL1 (0.58) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL18319571 0.82 OPRL1 (0.64) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL21753226 0.82 HDAC2 (0.47) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL21765220 0.82 OPRL1 (0.45) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL18319113 0.78 OPRL1 (0.52) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL21753291 0.78 OPRL1 (0.55) ITGB3ITGA2BOPRL1OPRM1
Hydrochloric Acid SCHEMBL21753277 0.77 OPRL1 (0.43) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL4072091 0.76 ITGB3 (0.51) ITGB3ITGA2B
SCHEMBL18319252 0.74 OPRL1 (0.47) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL23625435 0.73 OPRL1 (0.39) ITGB3ITGA2BOPRL1OPRM1

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-2020039029-A1 SPIRO COMPOUNDS AS GLYCOSIDASE INHIBITORS ASCENEURON S. A. (CH) 2020-02-27 WO disclosed