SCHEMBL4698476

SCHEMBL4698476

CC(=Cc1ccc(F)cc1F)CN(C(=O)c1ccc(OC(F)F)c(O)c1)C(C1CCCN1)C(NS(C)(=O)=O)C1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 6/20 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
SCHEMBL4698474 0.83 ACKR3 (0.38) ACKR3
SCHEMBL4700612 0.82 ACKR3 (0.48) ACKR3
SCHEMBL4700265 0.81 ACKR3 (0.47) ACKR3
SCHEMBL4700267 0.81 ACKR3 (0.47) ACKR3
SCHEMBL5575554 0.70 ACKR3 (0.49) ACKR3
SCHEMBL3534544 0.70 ACKR3 (0.54) ACKR3
SCHEMBL14601239 0.69 ACKR3 (0.57) ACKR3
SCHEMBL5576818 0.69 ACKR3 (0.57) ACKR3
SCHEMBL4699933 0.69 ACKR3 (0.51) ACKR3
SCHEMBL4699928 0.69 ACKR3 (0.51) ACKR3

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-1909575-A2 SUBSTITUTED N-CINNAMYL BENZAMIDES ChemoCentryx Inc (US) 2008-04-16 EP disclosed
WO-2007002842-A2 SUBSTITUTED N-CINNAMYL BENZAMIDES CHEMOCENTRYX, INC. (US) 2007-01-04 WO disclosed