SCHEMBL10693113

SCHEMBL10693113

FC(F)(F)Sc1ccc2c(c1)nc(C(F)(F)F)n2SC(F)(Cl)Cl

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.33
IDH1 O75874 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL10690077 0.93 KMT2A (0.30) SMN1; SMN2ALDH1A1
SCHEMBL10691690 0.89 KCNH2 (0.39) KCNH2SMN1; SMN2KDM4EALDH1A1TDP1
SCHEMBL10690618 0.82 MEN1 (0.42) KDM4E
SCHEMBL10694763 0.77 KDM4E (0.33) KDM4EALDH1A1
SCHEMBL10693333 0.77 IDH1 (0.36) SMN1; SMN2IDH1
SCHEMBL10695942 0.77 ALDH1A1 (0.48) SMN1; SMN2KDM4EALDH1A1
SCHEMBL10693958 0.76 SCN5A (0.36) SMN1; SMN2IDH1KDM4EALDH1A1
SCHEMBL10694821 0.75 SCN5A (0.36) SMN1; SMN2IDH1
SCHEMBL9814421 0.72 NOTUM (0.32)
SCHEMBL10603073 0.72 KCNH2 (0.38) KCNH2SMN1; SMN2KDM4EALDH1A1TDP1

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