SCHEMBL4688153

SCHEMBL4688153

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

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.43
MAPT P10636 5/20 0.42
KDR P35968 11/20 0.41
FLT1 P17948 10/20 0.41
CCR2 P41597 1/20 0.39
TP53 P04637 3/20 0.39
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.36

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
SCHEMBL4687903 0.94 CCR3 (0.43) CCR3MAPTKDRFLT1CCR2
SCHEMBL4688345 0.93 CCR3 (0.46) CCR3MAPTKDRFLT1CCR2
SCHEMBL4232358 0.91 FLT1 (0.36) CCR3MAPTKDRFLT1TP53
SCHEMBL4689332 0.91 CCR3 (0.42) CCR3MAPTKDRFLT1CCR2
SCHEMBL4688202 0.89 CCR3 (0.44) CCR3MAPTKDRFLT1CCR2
SCHEMBL4687050 0.89 CCR3 (0.46) CCR3MAPTKDRFLT1CCR2
SCHEMBL4687195 0.88 CCR3 (0.47) CCR3MAPTKDRFLT1CCR2
SCHEMBL4689230 0.86 CCR3 (0.42) CCR3KDRFLT1KMT2ARAB9A
SCHEMBL4236747 0.85 TAS1R3 (0.39) KDRFLT1
SCHEMBL4689324 0.85 CCR3 (0.44) CCR3MAPTKDRFLT1CCR2

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