SCHEMBL4687903

SCHEMBL4687903

CCCCCNC(=O)Nc1cc(OC)c(Oc2ccc(NC(=O)c3cc(C)c(OC4CCN(CCCC)CC4)cc3F)cc2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.43
MCHR2 Q969V1 1/20 0.40
MCHR1 Q99705 1/20 0.40
KDR P35968 8/20 0.39
FLT1 P17948 7/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
HTR2A P28223 1/20 0.39
CCR2 P41597 1/20 0.39
HTR3A P46098 1/20 0.39
FLT4 P35916 1/20 0.38
MAPT P10636 1/20 0.37
GFER P55789 1/20 0.37

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
SCHEMBL4688153 0.94 CCR3 (0.43) CCR3KDRFLT1CCR2MAPT
SCHEMBL4688202 0.94 CCR3 (0.44) CCR3MCHR2MCHR1KDRFLT1
SCHEMBL4689230 0.91 CCR3 (0.42) CCR3MCHR1KDRFLT1POLB
SCHEMBL4236747 0.91 TAS1R3 (0.39) MCHR2MCHR1KDRFLT1FLT4
SCHEMBL4687050 0.89 CCR3 (0.46) CCR3MCHR2MCHR1KDRFLT1
SCHEMBL4688345 0.88 CCR3 (0.46) CCR3MCHR2MCHR1KDRFLT1
SCHEMBL4683563 0.88 CCR3 (0.47) CCR3MCHR2MCHR1KDRHTR2A
SCHEMBL4232358 0.86 FLT1 (0.36) CCR3KDRFLT1MAPT
SCHEMBL4689332 0.86 CCR3 (0.42) CCR3MCHR1KDRFLT1CCR2
SCHEMBL4229412 0.85 TAS1R3 (0.40) MCHR2MCHR1KDRFLT1FLT4

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