SCHEMBL7436974

SCHEMBL7436974

Cc1ccc2cc(CNC3CN4CCC3CC4)[nH]c2c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CHRNA7 P36544 4/20 0.41
HTR3A P46098 2/20 0.41
CHEK1 O14757 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
SSTR3 P32745 1/20 0.36
HIF1A Q16665 2/20 0.35
ITK Q08881 1/20 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
SCHEMBL7453786 0.86 GAA (0.56) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL7444647 0.84 GAA (0.51) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL8112152 0.81 GAA (0.41) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL7444939 0.78 GAA (0.44) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL7448878 0.73 GAA (0.56) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL8116751 0.71 GAA (0.50) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL8110562 0.71 RAB9A (0.40) CHRNA7HTR3ASIGMAR1RAB9AALDH1A1
SCHEMBL261126 0.68 GAA (0.54) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL260641 0.68 GAA (0.54) GAAMEN1KMT2ASMN1; SMN2CHRNA7
SCHEMBL261276 0.68 GAA (0.54) GAAMEN1KMT2ASMN1; SMN2CHRNA7

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