SCHEMBL4683789

SCHEMBL4683789

CCCCCNC(=O)Nc1ccc(Oc2ccc(NC(=O)c3ccc(OC4CCN(CCCC)CC4)c(OC)c3)cc2)cc1F

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CCR3 P51677 1/20 0.43
FLT1 P17948 4/20 0.42
KDR P35968 4/20 0.42
FLT4 P35916 3/20 0.42
HTR4 Q13639 1/20 0.42
RAB9A P51151 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
PDE4D Q08499 1/20 0.41
MCHR1 Q99705 2/20 0.41
SLC5A7 Q9GZV3 1/20 0.41
MCHR2 Q969V1 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
SCHEMBL4690097 0.97 CCR3 (0.45) MEN1KMT2ACCR3FLT1KDR
SCHEMBL4688007 0.92 CCR3 (0.44) MEN1KMT2ACCR3FLT1KDR
SCHEMBL4240272 0.90 LMNA (0.42) MEN1KMT2AFLT1KDRFLT4
SCHEMBL4688854 0.90 CCR3 (0.45) MEN1KMT2ACCR3FLT1KDR
SCHEMBL4689230 0.89 CCR3 (0.42) MEN1KMT2ACCR3FLT1KDR
SCHEMBL4688728 0.89 MCHR1 (0.47) MEN1KMT2ACCR3KDRHTR4
SCHEMBL4684563 0.88 KDR (0.44) CCR3FLT1KDRDRD2DRD3
SCHEMBL4240643 0.87 PDE4D (0.42) FLT1KDRFLT4HTR4POLB
SCHEMBL4540719 0.86 MCHR1 (0.44) CCR3HTR4POLBMAPTDRD2
SCHEMBL4689324 0.85 CCR3 (0.44) MEN1KMT2ACCR3FLT1KDR

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