SCHEMBL6589032

SCHEMBL6589032

CCCCC(C)=CCCN1CCC(NC(=O)C(O)(c2ccccc2)C2CCCC2)CC1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 17/20 0.78
CHRM1 P11229 17/20 0.78
CHRM3 P20309 17/20 0.78

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
SCHEMBL6593594 1.00 CHRM2 (0.78) CHRM2CHRM1CHRM3
SCHEMBL6589029 1.00 CHRM2 (0.78) CHRM2CHRM1CHRM3
SCHEMBL7471958 0.88 CHRM2 (0.82) CHRM2CHRM1CHRM3
SCHEMBL7471963 0.88 CHRM2 (0.82) CHRM2CHRM1CHRM3
SCHEMBL7471969 0.88 CHRM2 (0.82) CHRM2CHRM1CHRM3
SCHEMBL508757 0.88 CHRM2 (1.00) CHRM2CHRM1CHRM3
SCHEMBL508756 0.88 CHRM2 (1.00) CHRM2CHRM1CHRM3
SCHEMBL6588781 0.87 CHRM2 (0.74) CHRM2CHRM1CHRM3
SCHEMBL6588779 0.87 CHRM2 (0.74) CHRM2CHRM1CHRM3
SCHEMBL6589586 0.87 CHRM2 (0.74) CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823423-B1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-06-16 EP disclosed
US-5750540-A SIDE EFFECT REDUCTION BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
EP-0823423-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-02-11 EP disclosed