SCHEMBL10694763

SCHEMBL10694763

FC(F)(Cl)Oc1ccc2c(c1)nc(C(F)(F)F)n2SC(F)(Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
ACSS2 Q9NR19 2/20 0.32
CYP1A2 P05177 1/20 0.30
SCN5A Q14524 1/20 0.30
MAPT P10636 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
SCHEMBL10693333 0.92 IDH1 (0.36) CYP1A2SCN5A
SCHEMBL10693091 0.89 TRPV1 (0.33) KDM4EALDH1A1HPGDACSS2
SCHEMBL10694821 0.87 SCN5A (0.36) ACSS2CYP1A2SCN5AMAPT
SCHEMBL10693958 0.86 SCN5A (0.36) KDM4EALDH1A1ACSS2CYP1A2SCN5A
SCHEMBL10695710 0.83 PDE10A (0.39) KDM4EALDH1A1HPGDCYP1A2SCN5A
SCHEMBL10690618 0.81 MEN1 (0.42) KDM4ECYP1A2
SCHEMBL10690077 0.78 KMT2A (0.30) ALDH1A1HPGDCYP1A2
SCHEMBL10693113 0.77 KCNH2 (0.36) KDM4EALDH1A1
SCHEMBL10695942 0.76 ALDH1A1 (0.48) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL10696167 0.76 PGK1 (0.32)

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