SCHEMBL7560109

SCHEMBL7560109

O=C(OCC(Cl)(Cl)Cl)OC1C(c2ccc(F)cc2)CC2CCC1N2C(=O)OCC(Cl)(Cl)Cl

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.41
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 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
SCHEMBL6041374 0.92 SLC6A4 (0.42) SLC6A3SLC6A2SLC6A4CHRM2CHRM4
SCHEMBL6041266 0.82 SLC6A3 (0.41) SLC6A3SLC6A2SLC6A4CHRM2CHRM4
SCHEMBL7952076 0.71 CHRM1 (0.41) CHRM2CHRM4CHRM1CHRM3
SCHEMBL9243087 0.66 SLC6A3 (0.54) SLC6A3SLC6A2SLC6A4
SCHEMBL6991525 0.65 SIGMAR1 (0.36) SLC6A3SLC6A4CHRM1
SCHEMBL2190026 0.65 CHRM1 (0.54) CHRM2CHRM4CHRM1CHRM3
SCHEMBL2190030 0.65 CHRM1 (0.54) CHRM2CHRM4CHRM1CHRM3
SCHEMBL6043904 0.64 SLC6A3 (0.49) SLC6A3SLC6A2SLC6A4
SCHEMBL857819 0.64 CHRM1 (0.38) CHRM2CHRM4CHRM1CHRM3
SCHEMBL12507091 0.62 CHRM1 (0.37) CHRM2CHRM4CHRM1CHRM3

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-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed