SCHEMBL9469387

SCHEMBL9469387

Clc1cccc(OC2CN3CCC2CC3)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
ATM Q13315 1/20 0.47
LSS P48449 1/20 0.46
TSHR P16473 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
MAPT P10636 1/20 0.43
GLA P06280 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CHRNA7 P36544 1/20 0.40
HTR3A P46098 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40

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
SCHEMBL13429317 1.00 GAA (0.47) GAAATMLSSTSHRRXFP1
Hydrochloric Acid SCHEMBL9469940 0.86 GAA (0.51) GAAATMLSSTSHRRXFP1
SCHEMBL9469749 0.83 GAA (0.50) GAAATMLSSTSHRRXFP1
SCHEMBL3840344 0.76 CNR2 (0.46) GAAATMTSHRRXFP1CHRNA7
SCHEMBL3840340 0.76 CNR2 (0.46) GAAATMTSHRRXFP1CHRNA7
SCHEMBL9469137 0.76 LSS (0.52) GAAATMLSSTSHRRXFP1
SCHEMBL9469800 0.75 CHRM2 (0.45) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL9469096 0.75 CHRM2 (0.45) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL9469146 0.75 CHRM2 (0.45) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL9469630 0.75 CHRM2 (0.45) CHRNA7CHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5258392-A 3-quinuclidine derivatives AKZO N.V. (NL) 1993-11-02 US disclosed
EP-0497415-A1 3-Quinuclidine derivatives Akzo Nobel N.V. (NL) 1992-08-05 EP disclosed