SCHEMBL7704271

SCHEMBL7704271

CC(=O)Nc1cncc(Oc2ccc(C(=O)NC3CN4CCC3CC4)c(C)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 4/20 0.46
HTR3A P46098 2/20 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

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
SCHEMBL6880991 0.89 CHRNA7 (0.52) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL7706749 0.89 CHRNA7 (0.52) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6879605 0.78 CHRNA7 (0.55) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6884610 0.77 CHRNA7 (0.54) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL372989 0.76 CHRNA7 (0.60) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6880994 0.76 CHRNA7 (0.55) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6880646 0.74 CHRNA7 (0.65) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6874525 0.74 CHRNA7 (0.64) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6883595 0.74 CHRNA7 (0.52) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6884473 0.73 CHRNA7 (0.51) CHRNA7HTR3AHTR3EHTR3BALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002016357-A2 QUINUCLIDINE-SUBSTITUTED ARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS) PHARMACIA & UPJOHN COMPANY (US) 2002-02-28 WO claimed