SCHEMBL4686765

SCHEMBL4686765

CCCCCNC(=O)Nc1ccc(Oc2ccc(NC(=O)c3ccc(N(C)C4CCN(CCCC)CC4)cc3)cc2)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 6/20 0.46
MCHR2 Q969V1 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HTR3A P46098 1/20 0.42
CCR3 P51677 2/20 0.42
KDR P35968 1/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
NAMPT P43490 1/20 0.41
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
FGFR1 P11362 1/20 0.41
TP53 P04637 2/20 0.41
HTR4 Q13639 1/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL4688001 0.90 CCR3 (0.40) MCHR1MCHR2HTR3ACCR3KDR
SCHEMBL4236573 0.89 MCHR1 (0.45) MCHR1MCHR2SMN1; SMN2NPSR1KDR
SCHEMBL4688079 0.89 MAPT (0.42) MCHR1MAPTKMT2ATP53ALDH1A1
SCHEMBL4688728 0.86 MCHR1 (0.47) MCHR1MCHR2SMN1; SMN2NPSR1HTR3A
SCHEMBL4686821 0.85 CHRM4 (0.48) MCHR1MCHR2SMN1; SMN2CCR3MAPT
SCHEMBL4687404 0.85 MCHR1 (0.47) MCHR1MCHR2SMN1; SMN2NPSR1CCR3
SCHEMBL4240513 0.84 MCHR1 (0.40) MCHR1SMN1; SMN2NPSR1MAPTMEN1
SCHEMBL4683061 0.84 MCHR1 (0.45) MCHR1MCHR2SMN1; SMN2NPSR1HTR3A
SCHEMBL4683393 0.84 FGFR1 (0.48) MCHR1MCHR2SMN1; SMN2NPSR1HTR3A
SCHEMBL4689248 0.83 MCHR1 (0.45) MCHR1MCHR2SMN1; SMN2NPSR1HTR3A

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-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP claimed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO claimed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO disclosed