SCHEMBL22018773

SCHEMBL22018773

CC(=O)n1c(SC(F)(F)C(=O)N(C)c2ccccc2)nnc1C1CC=CS1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.31
KMT2A Q03164 1/20 0.31
POLQ O75417 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
SCHEMBL13831835 0.77 ALDH1A1 (0.40) KMT2A
SCHEMBL13832055 0.75 RECQL (0.44) KMT2A
SCHEMBL13831862 0.74 ALDH1A1 (0.33) KMT2A
SCHEMBL13831713 0.72 ALDH1A1 (0.42) KMT2A
SCHEMBL13831214 0.72 ALDH1A1 (0.37) KMT2A
SCHEMBL22018783 0.72 ALDH1A1 (0.34) RIPK1KMT2A
SCHEMBL13831000 0.72 NPC1 (0.41) KMT2A
SCHEMBL13831433 0.71 ALDH1A1 (0.41) KMT2A
SCHEMBL13831525 0.68 USP30 (0.35) KMT2A
SCHEMBL13831837 0.67 ALDH1A1 (0.37) KMT2A

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-3653054-A1 COMPOSITION FOR INHIBITION OF INSECT SENSING Vanderbilt University (US) 2020-05-20 EP disclosed