SCHEMBL4684906

SCHEMBL4684906

CCCCCNC(=O)Nc1ccc(Oc2ccc(NC(=O)c3ccc(OC4CCN(CCCC)CC4)cc3Cl)cc2)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.48
MCHR2 Q969V1 1/20 0.48
USP2 O75604 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
MCL1 Q07820 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CCR3 P51677 2/20 0.44
PNLIP P16233 1/20 0.43
FLT1 P17948 1/20 0.43
FLT4 P35916 1/20 0.43
KDR P35968 1/20 0.43
QPCT Q16769 2/20 0.43
HTR3A P46098 1/20 0.42
DRD2 P14416 1/20 0.41
ADRA1A P35348 1/20 0.41
DRD3 P35462 1/20 0.41
HTR4 Q13639 2/20 0.41

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
SCHEMBL4689244 0.91 CCR3 (0.49) MCHR1MCHR2MAPTSMN1; SMN2NPSR1
SCHEMBL4233974 0.89 SMN1; SMN2 (0.44) MCHR1MCHR2SMN1; SMN2NPSR1CCR3
SCHEMBL4689248 0.89 MCHR1 (0.45) MCHR1MCHR2USP2LMNAMAPT
SCHEMBL4688728 0.87 MCHR1 (0.47) MCHR1MCHR2MAPTSMN1; SMN2NPSR1
SCHEMBL4683563 0.86 CCR3 (0.47) MCHR1MCHR2MAPTSMN1; SMN2NPSR1
SCHEMBL4683061 0.85 MCHR1 (0.45) MCHR1MCHR2MAPTHTTSMN1; SMN2
SCHEMBL4683393 0.85 FGFR1 (0.48) MCHR1MCHR2LMNAMAPTHTT
SCHEMBL4683553 0.84 CCR3 (0.49) MCHR1MCHR2USP2LMNAMAPT
SCHEMBL4683722 0.83 MAPT (0.49) MCHR1MCHR2LMNAMAPTHTT
SCHEMBL4687404 0.83 MCHR1 (0.47) MCHR1MCHR2LMNAMAPTHTT

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-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