SCHEMBL7453786

SCHEMBL7453786

Clc1ccc2cc(CNC3CN4CCC3CC4)[nH]c2c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SIGMAR1 Q99720 4/20 0.44
DRD4 P21917 3/20 0.43
DRD3 P35462 2/20 0.43
DRD5 P21918 1/20 0.43
HTR3A P46098 6/20 0.41
CHRNA7 P36544 4/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
CHEK1 O14757 2/20 0.39

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
SCHEMBL7436974 0.86 GAA (0.44) GAASMN1; SMN2MEN1KMT2ASIGMAR1
SCHEMBL7444647 0.84 GAA (0.51) GAASMN1; SMN2MEN1KMT2ACHRNA7
SCHEMBL8116751 0.81 GAA (0.50) GAASMN1; SMN2MEN1KMT2ASIGMAR1
SCHEMBL7448878 0.78 GAA (0.56) GAASMN1; SMN2MEN1KMT2ASIGMAR1
SCHEMBL7444939 0.73 GAA (0.44) GAASMN1; SMN2MEN1KMT2ASIGMAR1
SCHEMBL4958523 0.72 GAA (0.68) GAASMN1; SMN2MEN1KMT2ASIGMAR1
SCHEMBL8112152 0.71 GAA (0.41) GAASMN1; SMN2MEN1KMT2ASIGMAR1
SCHEMBL8111998 0.70 CHRM1 (0.39) MEN1KMT2ASIGMAR1DRD4DRD3
SCHEMBL260641 0.68 GAA (0.54) GAASMN1; SMN2MEN1KMT2ASIGMAR1
SCHEMBL261126 0.68 GAA (0.54) GAASMN1; SMN2MEN1KMT2ASIGMAR1

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