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SCHEMBL4684563

SCHEMBL4684563

CCCCCNC(=O)Nc1ccc(Oc2ccc(NC(=O)c3ccc(OC4CCN(CCCC)CC4)c(C)c3)c(F)c2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 9/20 0.44
▸ FLT1 P17948 7/20 0.44
▸ CCR3 P51677 1/20 0.42
▸ MCHR1 Q99705 5/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ PDE4D Q08499 1/20 0.38

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
SCHEMBL4688854 0.96 CCR3 (0.45) KDRFLT1CCR3MCHR1
SCHEMBL4688007 0.96 CCR3 (0.44) KDRFLT1CCR3MCHR1
SCHEMBL4686866 0.91 CCR3 (0.44) KDRFLT1CCR3MCHR1
SCHEMBL4238014 0.89 PKM (0.40) KDRFLT1MCHR1HRH3DRD2
SCHEMBL4236294 0.89 HTR4 (0.45) KDRFLT1HRH3PDE4D
SCHEMBL4689324 0.88 CCR3 (0.44) KDRFLT1CCR3MCHR1
SCHEMBL4690097 0.88 CCR3 (0.45) KDRFLT1CCR3MCHR1DRD2
SCHEMBL4683789 0.88 MEN1 (0.44) KDRFLT1CCR3MCHR1DRD2
SCHEMBL4540719 0.88 MCHR1 (0.44) CCR3MCHR1DRD2DRD3
SCHEMBL4684519 0.87 MAPT (0.45) CCR3MCHR1HRH3

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