SCHEMBL7448151

SCHEMBL7448151

CN1[C@@H]2CC[C@H]1C[C@H](C(N)c1cc3ccccc3[nH]1)C2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.41
SLC6A2 P23975 2/20 0.40
SLC6A3 Q01959 2/20 0.40
ALOX5 P09917 1/20 0.40
VCP P55072 1/20 0.40
HRH3 Q9Y5N1 2/20 0.40
HRH4 Q9H3N8 1/20 0.39
DRD2 P14416 2/20 0.38
DRD3 P35462 2/20 0.38
CHRM2 P08172 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
DRD4 P21917 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
DRD1 P21728 1/20 0.38
HRH2 P25021 1/20 0.38

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
SCHEMBL7447996 1.00 CHRNA7 (0.41) CHRNA7SLC6A2SLC6A3ALOX5VCP
SCHEMBL7973510 0.75 SLC6A3 (0.43) CHRNA7SLC6A2SLC6A3VCPHRH3
SCHEMBL9880049 0.72 ALOX5 (0.43) ALOX5HRH3HRH4
SCHEMBL7448002 0.72 HRH3 (0.48) CHRNA7VCPHRH3HRH4DRD2
SCHEMBL7444644 0.70 CHRNB4 (0.44) CHRNA7ALOX5VCPCHRM2CHRM1
SCHEMBL7296680 0.70 HRH3 (0.52) CHRNA7VCPHRH3HRH4DRD2
SCHEMBL3229357 0.70 ALOX5 (0.55) ALOX5
SCHEMBL7814836 0.69 ALOX5 (0.50) ALOX5DRD2
SCHEMBL8102814 0.68 VCP (0.50) CHRNA7VCPHRH3HRH4CHRM4
SCHEMBL23468379 0.67 ALOX5 (0.51) ALOX5

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