SCHEMBL6585770

SCHEMBL6585770

O=C(NC1CCN(CC=CC2CCCC2)CC1)C(O)(c1ccccc1)C1CCCC1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.69
CHRM2 P08172 19/20 0.69
CHRM1 P11229 19/20 0.69

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
SCHEMBL6585769 1.00 CHRM3 (0.69) CHRM3CHRM2CHRM1
SCHEMBL6589773 1.00 CHRM3 (0.69) CHRM3CHRM2CHRM1
SCHEMBL6587498 0.88 CHRM2 (0.66) CHRM3CHRM2CHRM1
SCHEMBL6587502 0.88 CHRM2 (0.66) CHRM3CHRM2CHRM1
SCHEMBL6591981 0.87 CHRM2 (0.74) CHRM3CHRM2CHRM1
SCHEMBL6587135 0.87 CHRM2 (0.74) CHRM3CHRM2CHRM1
SCHEMBL6587132 0.87 CHRM2 (0.74) CHRM3CHRM2CHRM1
SCHEMBL6591815 0.83 CHRM2 (0.69) CHRM3CHRM2CHRM1
SCHEMBL6589275 0.83 CHRM2 (0.63) CHRM3CHRM2CHRM1
SCHEMBL6589281 0.83 CHRM2 (0.63) CHRM3CHRM2CHRM1

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-0823423-B1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-06-16 EP disclosed
CN-1188471-A 1,4-disubstituted piepridine derivatives BANYU PHARMA CO LTD (JP) 1998-07-22 CN 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