SCHEMBL8219167

SCHEMBL8219167

Brc1ccc2c(c1)C1CCCN1CC2

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.61
OPRM1 P35372 1/20 0.49
OPRD1 P41143 1/20 0.49
OPRK1 P41145 1/20 0.49

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
Iodide SCHEMBL8221206 0.98 CHRNA7 (0.59) CHRNA7OPRM1OPRD1OPRK1
SCHEMBL6494545 0.89 CHRNA7 (0.46) CHRNA7OPRM1OPRD1OPRK1
SCHEMBL7007153 0.81 CHRNA7 (0.61) CHRNA7
SCHEMBL22993435 0.81 CHRNA7 (0.61) CHRNA7
Iodide SCHEMBL8219528 0.79 CHRNA7 (0.59) CHRNA7
Hydrochloric Acid SCHEMBL7015509 0.79 CHRNA7 (0.59) CHRNA7
SCHEMBL29407568 0.77 CHRNA7 (0.56) CHRNA7
SCHEMBL22993239 0.77 CHRNA7 (0.56) CHRNA7
SCHEMBL8212966 0.77 TP53 (0.48) CHRNA7
SCHEMBL7510798 0.76 CHRNA7 (0.55) CHRNA7

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-2000008023-A1 CONDENSED TRICYCLIC PIPERIDINES HAVING ANTI-CONVULSANT ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2000-02-17 WO disclosed