SCHEMBL7510798

SCHEMBL7510798

Nc1ccc2c(c1)C1CCCCN1CC2

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.55

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
SCHEMBL7007153 0.95 CHRNA7 (0.61) CHRNA7
Iodide SCHEMBL8219528 0.94 CHRNA7 (0.59) CHRNA7
Hydrochloric Acid SCHEMBL7015509 0.94 CHRNA7 (0.59) CHRNA7
SCHEMBL7008801 0.89 CHRNA7 (0.53) CHRNA7
SCHEMBL521174 0.82 CNR1 (0.48) CHRNA7
SCHEMBL6406991 0.82 MTNR1B (0.47) CHRNA7
SCHEMBL3475010 0.77 CHRNA7 (0.90) CHRNA7
SCHEMBL14239889 0.77 CHRNA7 (0.90) CHRNA7
SCHEMBL22993435 0.76 CHRNA7 (0.61) CHRNA7
SCHEMBL8219167 0.76 CHRNA7 (0.61) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861250-B1 AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE ASTRAZENECA AB (SE) 2002-02-13 EP disclosed
US-6140322-A Amidine and isothiourea derivatives as inhibitors of nitric oxide synthase ASTRA AKTIEBOLAG (SE) 2000-10-31 US disclosed