SCHEMBL19915985

SCHEMBL19915985

CC(F)(F)CCSCCC(=O)Nc1cn(-c2cccnc2)nc1Cl

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 6/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 3/20 0.37
DGAT1 O75907 1/20 0.36
IRAK4 Q9NWZ3 4/20 0.35
TDP1 Q9NUW8 2/20 0.34
HPGD P15428 1/20 0.34
MEN1 O00255 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MITF O75030 1/20 0.34
XBP1 P17861 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL15346979 0.93 KMT2A (0.41) KMT2AALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL15910340 0.85 KMT2A (0.43) KMT2AALDH1A1GAALMNAPOLB
SCHEMBL2689981 0.84 GAA (0.41) KMT2AALDH1A1GAASMN1; SMN2LMNA
SCHEMBL4965309 0.82 KMT2A (0.42) KMT2AALDH1A1LMNAPOLBDGAT1
SCHEMBL20346382 0.82 GAA (0.39) KMT2AALDH1A1GAASMN1; SMN2LMNA
SCHEMBL15359836 0.82 IRAK4 (0.35) KMT2AALDH1A1SMN1; SMN2LMNAPOLB
SCHEMBL16659472 0.81 HTT (0.44) KMT2AALDH1A1GAASMN1; SMN2LMNA
SCHEMBL16269920 0.80 POLB (0.36) KMT2AALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL16652373 0.80 ALDH1A1 (0.44) KMT2AALDH1A1GAALMNAPOLB
SCHEMBL15346746 0.79 DGAT1 (0.36) KMT2AALDH1A1DGAT1HTT

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-2018039028-A1 FOLIAR APPLICATIONS FOR CONTROLLING LEPIDOPTERAN PESTS FOR FRUITS AND/OR FRUIT TREES DOW AGROSCIENCES LLC (US) 2018-03-01 WO disclosed