SCHEMBL7444644

SCHEMBL7444644

NC(c1cc2ccccc2[nH]1)C1CN2CCC1CC2

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 2/20 0.44
CHRNA3 P32297 2/20 0.44
CHRNA7 P36544 3/20 0.37
HTR3A P46098 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
ALOX5 P09917 1/20 0.36
VCP P55072 1/20 0.35
AOC3 Q16853 2/20 0.35

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
SCHEMBL5699040 0.73 CHRNA7 (0.53) CHRNB4CHRNA3CHRNA7HTR3ACHRM2
SCHEMBL7447996 0.70 CHRNA7 (0.41) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL7448151 0.70 CHRNA7 (0.41) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL7444647 0.65 GAA (0.51) CHRNA7
SCHEMBL23468379 0.65 ALOX5 (0.51) ALOX5AOC3
SCHEMBL3229357 0.65 ALOX5 (0.55) ALOX5AOC3
SCHEMBL5049788 0.65 AOC3 (0.50) ALOX5AOC3
SCHEMBL9880049 0.65 ALOX5 (0.43) ALOX5AOC3
SCHEMBL8598079 0.64 AOC3 (0.52) ALOX5AOC3
SCHEMBL31676678 0.64 AOC3 (0.52) ALOX5AOC3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711299-B1 AZABICYCLOALKYL DERIVATIVES OF IMIDAZO(1,5-a)INDOL-3-ONE AS 5HT 3 ANTAGONISTS PHARMACIA & UPJOHN SPA (IT) 2000-01-05 EP disclosed
US-5637596-A REACTING AMINOMETHYLINDOLE DERIVATIVE WITH A CARBONYL CONTAINING CYCLIZING AGENT; 5-HT3 RECEPTOR ATAGONIST; USEFUL FOR TREATING ANXIETY, PSYCHOSIS, GUT MOTILITY DISORDER, EMESIS, MIGRAINE AND DRUG ADDICTION PHARMACIA S.P.A. (IT) 1997-06-10 US disclosed
EP-0711299-A1 AZABICYCLOALKYL DERIVATIVES OF IMIDAZO(1,5-a)INDOL-3-ONE AS 5HT 3 ANTAGONISTS PHARMACIA & UPJOHN S.p.A. (IT) 1996-05-15 EP disclosed
WO-1995032209-A1 AZABICYCLOALKYL DERIVATIVES OF IMIDAZO(1,5-a)INDOL-3-ONE AS 5HT3 ANTAGONISTS PHARMACIA S.P.A. (IT) 1995-11-30 WO disclosed