SCHEMBL6592141

SCHEMBL6592141

O=C(NC1CCN(CC2CCC=CCC2)CC1)C(O)(c1ccccc1)C1CCCC1

nearest known ligand 0.88

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 19/20 0.88
CHRM1 P11229 19/20 0.88
CHRM3 P20309 19/20 0.88
CCR1 P32246 1/20 0.66

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
SCHEMBL8551717 0.95 CHRM2 (0.79) CHRM2CHRM1CHRM3CCR1
SCHEMBL6585812 0.93 CHRM2 (1.00) CHRM2CHRM1CHRM3CCR1
SCHEMBL6590357 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CCR1
SCHEMBL6588284 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CCR1
SCHEMBL6589992 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CCR1
SCHEMBL6587596 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CCR1
SCHEMBL6589582 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CCR1
Hydrochloric Acid SCHEMBL6589254 0.91 CHRM2 (0.98) CHRM2CHRM1CHRM3CCR1
SCHEMBL6588842 0.91 CHRM2 (0.98) CHRM2CHRM1CHRM3CCR1
SCHEMBL6588874 0.90 CHRM2 (0.81) CHRM2CHRM1CHRM3CCR1

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