SCHEMBL6183399

SCHEMBL6183399

CC(=O)NC1CCN(c2ccc(Cl)c(C(F)(F)F)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 14/20 0.61
TSHR P16473 1/20 0.53
CCNC P24863 1/20 0.52
CDK8 P49336 1/20 0.52
EPHX2 P34913 1/20 0.51
NPY5R Q15761 1/20 0.47
DPP4 P27487 1/20 0.47

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
SCHEMBL14414271 0.77 ITGB2 (0.52) NOTUMCCNCCDK8
SCHEMBL20080888 0.77 NOTUM (0.58) NOTUMDPP4
SCHEMBL29141955 0.76 NOTUM (0.64) NOTUMDPP4
SCHEMBL4169504 0.76 NPY5R (0.53) NOTUMNPY5R
SCHEMBL3805648 0.74 NOTUM (0.61) NOTUM
SCHEMBL1409621 0.74 NOTUM (0.68) NOTUMDPP4
SCHEMBL21434104 0.73 SMO (0.49)
SCHEMBL28234009 0.73 NOTUM (0.67) NOTUMDPP4
SCHEMBL13724538 0.73 GFER (0.57) EPHX2
SCHEMBL22542098 0.73 DRD2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513835-A1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2005-03-16 EP disclosed
WO-2003104225-A1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2003-12-18 WO disclosed