SCHEMBL3467348

SCHEMBL3467348

CCOC(=O)c1cccc(CC2Cc3cc(-c4ccc(C(F)(F)F)cc4)ccc3NC2=O)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.41
MAPT P10636 1/20 0.40
FFAR1 O14842 1/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.38
SYK P43405 1/20 0.37
PDK2 Q15119 1/20 0.36
PTGES O14684 1/20 0.36
TSHR P16473 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
SCHEMBL3467352 0.87 KIF11 (0.45) KIF11FFAR1
SCHEMBL3467503 0.81 KIF11 (0.44) KIF11MAPTFFAR1
SCHEMBL3468115 0.79 KIF11 (0.47) KIF11FFAR1
SCHEMBL4596470 0.77 KIF11 (0.49) KIF11MAPTGPBAR1TSHR
SCHEMBL4891219 0.75 KIF11 (0.56) KIF11FFAR1
SCHEMBL3308412 0.74 KIF11 (0.53) KIF11
SCHEMBL3468263 0.74 KIF11 (0.53) KIF11FFAR1
SCHEMBL3467771 0.74 KIF11 (0.48) KIF11FFAR1
SCHEMBL3467592 0.73 KIF11 (0.52) KIF11
SCHEMBL3308461 0.73 MAPT (0.48) MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010074807-A1 3, 4-DIHYDROQUINOLIN-2 ( 1H ) -ONE DERIVATIVES AS SODIUM CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-07-01 WO disclosed