SCHEMBL6926065

SCHEMBL6926065

Nc1scc(-c2ccc(C(F)(F)F)cc2F)c1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MPL P40238 2/20 0.50
PRKCZ Q05513 1/20 0.46
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
APP P05067 2/20 0.43
ALOX5AP P20292 8/20 0.42
FEN1 P39748 8/20 0.42
ANO1 Q5XXA6 1/20 0.39
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
PIM1 P11309 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
CDC14B O60729 1/20 0.36
CDC14A Q9UNH5 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
SCHEMBL6924898 0.81 PRKCZ (0.47) PRKCZALDH1A1HPGDANO1
SCHEMBL6924937 0.81 PRKCZ (0.53) PRKCZALDH1A1HPGDHSD17B10ANO1
SCHEMBL28599809 0.80 PRKCZ (0.48) PRKCZKDM4EALDH1A1HPGDHSD17B10
SCHEMBL12466271 0.78 ADORA1 (0.49) PRKCZKDM4EALDH1A1HPGDHSD17B10
SCHEMBL12465762 0.77 PRKCZ (0.47) MPLPRKCZKDM4EALDH1A1HPGD
SCHEMBL6926076 0.77 MPL (0.51) MPLPRKCZAPPALOX5APFEN1
SCHEMBL6925990 0.71 PRKCZ (0.38) PRKCZKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6925553 0.70 MAPT (0.43) PRKCZKDM4EALDH1A1HPGDHSD17B10
SCHEMBL2367950 0.69 PRKCZ (0.63) PRKCZALDH1A1HPGDHSD17B10ANO1
SCHEMBL2368735 0.69 GRIN2C (0.56) PRKCZKDM4EALDH1A1HPGDHSD17B10

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-2011109551-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-09-09 WO disclosed