SCHEMBL14535343

SCHEMBL14535343

CC(F)Oc1cccc2c1C(N(C)CC#N)=NS2(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
LMNA P02545 1/20 0.32
NPC1 O15118 1/20 0.31

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
SCHEMBL13903651 0.92 KCNA3 (0.35) KCNA3MEN1KMT2ALMNANPC1
SCHEMBL14535347 0.89 LMNA (0.32) MEN1KMT2ALMNANPC1
SCHEMBL14535342 0.86 ALDH1A1 (0.34) KCNA3MEN1KMT2ALMNANPC1
SCHEMBL14535493 0.85 LMNA (0.33) KCNA3MEN1KMT2ALMNANPC1
SCHEMBL14535345 0.84 LMNA (0.37) KCNA3MEN1KMT2ALMNANPC1
SCHEMBL14535349 0.83 KMT2A (0.35) KCNA3MEN1KMT2ALMNANPC1
SCHEMBL14535346 0.82 LMNA (0.40) KCNA3MEN1KMT2ALMNANPC1
SCHEMBL14535348 0.81 KMT2A (0.34) KCNA3MEN1KMT2ALMNANPC1
SCHEMBL13903654 0.81 LMNA (0.32) MEN1KMT2ALMNANPC1
SCHEMBL14535492 0.80 ALDH1A1 (0.40) KCNA3MEN1KMT2ALMNANPC1

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-2007057407-A2 INSECTICIDAL METHODS USING 3-AMINO-1,2-BENZISOTHIAZOLE DERIVATIVES BASF SE (DE) 2007-05-24 WO disclosed