SCHEMBL6682444

SCHEMBL6682444

Cc1cc(C(F)(F)F)cc(C(=O)Nc2ccc(OC(N)=O)cc2)c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.47
SMO Q99835 8/20 0.46
KIF11 P52732 1/20 0.45
PTGS1 P23219 1/20 0.44
MTTP P55157 5/20 0.43
APOB P04114 4/20 0.43
P2RX1 P51575 2/20 0.43
RUVBL1 Q9Y265 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL6678296 0.80 POLB (0.46) ALDH1A1MAPTHPGDPOLBGAA
SCHEMBL2990416 0.73 MTTP (0.67) SMOMTTPAPOB
SCHEMBL6027598 0.73 RXRA (0.55) ALDH1A1MAPTHPGD
SCHEMBL7079762 0.72 RXFP1 (0.73)
SCHEMBL3290068 0.71 EPHX2 (0.45) SMOMTTPAPOB
SCHEMBL4197692 0.71 MTTP (0.49) SMOMTTPAPOBMAPT
SCHEMBL7083823 0.69 POLB (0.61) KIF11ALDH1A1HPGDNPC1RAB9A
SCHEMBL3971988 0.69 RXFP1 (0.62) P2RX1MAPTHPGDNPC1RAB9A
SCHEMBL4997367 0.68 PTGS1 (0.61) PTGS1P2RX1MAPTRAB9AGAA
SCHEMBL28688539 0.68 MEN1 (0.64) ALDH1A1HPGDNPC1RAB9APOLB

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-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 WO disclosed