SCHEMBL7448345

SCHEMBL7448345

O=C(N[C@@H]1CN2CCC1CC2)c1ccccc1Cc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.54

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
SCHEMBL7441926 1.00 CHRNA7 (0.54) CHRNA7
SCHEMBL12196340 0.82 CHRNA7 (0.70) CHRNA7
SCHEMBL373028 0.82 CHRNA7 (0.70) CHRNA7
SCHEMBL7438039 0.81
SCHEMBL6101482 0.79
SCHEMBL7122170 0.79 CHRNA7 (0.61) CHRNA7
SCHEMBL1567250 0.78 HTR3A (0.61)
SCHEMBL9597743 0.78 CHRNA7 (0.60) CHRNA7
SCHEMBL7447481 0.78 HTR3A (0.56)
SCHEMBL7447489 0.78 HTR3A (0.56)

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
US-5491148-A TREATING GASTROINTESTINAL, CARDIOVASCULAR, CENTRAL NERVOUS SYSTEM DISORDERS, EMESIS, PAIN SYNTEX (U.S.A.) INC. (US) 1996-02-13 US disclosed