Sugi Predict

Sugi Predict / Compounds / SCHEMBL6589333

SCHEMBL6589333

SCHEMBL6589333

CCCCC(C)(C)CCN1CCC(NC(=O)C(O)(c2ccccc2)C2CCCC2)CC1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 20/20 0.66
▸ CHRM1 P11229 20/20 0.66
▸ CHRM3 P20309 20/20 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
SCHEMBL6587984 0.89 CHRM2 (0.71) CHRM2CHRM1CHRM3
SCHEMBL6586960 0.86 CHRM2 (0.67) CHRM2CHRM1CHRM3
SCHEMBL6588698 0.84 CHRM2 (0.65) CHRM2CHRM1CHRM3
SCHEMBL6591335 0.83 CHRM2 (0.64) CHRM2CHRM1CHRM3
SCHEMBL6589539 0.82 CHRM2 (0.67) CHRM2CHRM1CHRM3
SCHEMBL6589029 0.81 CHRM2 (0.78) CHRM2CHRM1CHRM3
SCHEMBL6593594 0.81 CHRM2 (0.78) CHRM2CHRM1CHRM3
SCHEMBL6589032 0.81 CHRM2 (0.78) CHRM2CHRM1CHRM3
SCHEMBL6590342 0.81 CHRM2 (0.81) CHRM2CHRM1CHRM3
SCHEMBL6589868 0.81 CHRM2 (0.69) 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 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