SCHEMBL6587799

SCHEMBL6587799

COCCC(=O)C(C1CCNCC1)N1CCC(N)CC1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.31
SLC6A4 P31645 5/20 0.31
SLC6A3 Q01959 4/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CPN1 P15169 1/20 0.31
CPB2 Q96IY4 1/20 0.31
KDM5A P29375 1/20 0.30
GNAI3 P08754 1/20 0.30
GNAO1 P09471 1/20 0.30
GNAI1 P63096 1/20 0.30

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
SCHEMBL6585899 0.80 SLC6A3 (0.43) SLC6A2SLC6A4SLC6A3CPN1CPB2
SCHEMBL6584546 0.79 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3CPN1CPB2
SCHEMBL6585188 0.76 CPN1 (0.34) SLC6A2SLC6A4SLC6A3CPN1CPB2
SCHEMBL6586743 0.75 CPN1 (0.32) SLC6A2SLC6A4SLC6A3CPN1CPB2
SCHEMBL7839828 0.75 OPRD1 (0.38) SLC6A2SLC6A4SLC6A3CPN1CPB2
SCHEMBL6586012 0.74 SMYD3 (0.32) SLC6A2SLC6A4SLC6A3CPN1CPB2
SCHEMBL6585288 0.72 HTR4 (0.66) SLC6A2SLC6A3
SCHEMBL6587854 0.72 HTR4 (0.51) SLC6A2SLC6A3MEN1KMT2A
SCHEMBL6584313 0.71 DPP4 (0.37) CPN1CPB2
SCHEMBL6586715 0.70 CA2 (0.38)

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-1076055-B1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS DAINIPPON PHARMACEUTICAL CO (JP) 2004-11-24 EP disclosed
US-6294555-B1 SEROTONIN HT3 RECEPTOR ANTAGONIST FOR GASTROINTESTINAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2001-09-25 US disclosed
EP-1076055-A1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS Dainippon Pharmaceutical Co., Ltd. (JP) 2001-02-14 EP disclosed