SCHEMBL4683393

SCHEMBL4683393

CCCCCNC(=O)Nc1ccc(Oc2ccc(NC(=O)c3ccc(OC4CCN(CCO)CC4)cc3)cc2)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.48
MCHR1 Q99705 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CCR3 P51677 1/20 0.46
MCHR2 Q969V1 1/20 0.45
HTR3A P46098 1/20 0.43
LMNA P02545 1/20 0.43
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43
QPCT Q16769 3/20 0.43
KDR P35968 1/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
NAMPT P43490 1/20 0.42
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 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
SCHEMBL4687404 0.92 MCHR1 (0.47) FGFR1MCHR1SMN1; SMN2NPSR1CCR3
SCHEMBL4688728 0.90 MCHR1 (0.47) MCHR1SMN1; SMN2NPSR1CCR3MCHR2
SCHEMBL4683722 0.89 MAPT (0.49) MCHR1SMN1; SMN2NPSR1CCR3MCHR2
SCHEMBL4683469 0.89 MCHR1 (0.52) MCHR1SMN1; SMN2MCHR2LMNAOPRM1
SCHEMBL4687069 0.89 HRH3 (0.48) KDRMEN1GAAMAPTHTT
SCHEMBL4683166 0.89 HRH3 (0.48) KDRMEN1GAAMAPTHTT
SCHEMBL4683061 0.88 MCHR1 (0.45) MCHR1SMN1; SMN2NPSR1CCR3MCHR2
SCHEMBL4689248 0.88 MCHR1 (0.45) MCHR1SMN1; SMN2NPSR1CCR3MCHR2
SCHEMBL4686982 0.87 CCR3 (0.49) MCHR1CCR3MCHR2HTR3ALMNA
SCHEMBL4683459 0.87 MAPT (0.45) FGFR1MCHR1SMN1; SMN2QPCTKDR

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