SCHEMBL10693016

SCHEMBL10693016

FC(F)(F)Oc1cccc2nc(C(F)(F)F)n(SC(F)(Cl)Cl)c12

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B13 Q7Z5P4 1/20 0.33
MPL P40238 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HCAR1 Q9BXC0 1/20 0.31
HSD11B1 P28845 1/20 0.30
PDE2A O00408 1/20 0.30
PDE10A Q9Y233 1/20 0.30
SCN9A Q15858 2/20 0.30
C1R P00736 1/20 0.30

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
SCHEMBL10690287 0.79 F2RL3 (0.32) HSD17B13MPLKDM4EALDH1A1HPGD
SCHEMBL10696167 0.76 PGK1 (0.32)
SCHEMBL10695942 0.73 ALDH1A1 (0.48) KDM4EALDH1A1HPGD
SCHEMBL10695710 0.72 PDE10A (0.39) KDM4EALDH1A1HPGDPDE2APDE10A
SCHEMBL10693333 0.71 IDH1 (0.36) PDE2APDE10ASCN9A
SCHEMBL10696207 0.70 SCN5A (0.32)
SCHEMBL10692362 0.69 SCN5A (0.36)
SCHEMBL10696194 0.69 PDE2A (0.35) KDM4EPDE2APDE10ASCN9A
SCHEMBL10691766 0.68
SCHEMBL10690283 0.67 LMNA (0.30)

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
EP-0251012-A2 N-sulfenyl-2-trifluoromethyl benzimidazoles BAYER AG (DE) 1988-01-07 EP disclosed