SCHEMBL7935810

SCHEMBL7935810

O=c1cc(C(F)(F)F)cnn1-c1cc(Oc2ccccn2)c(Cl)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NPC1 O15118 2/20 0.34
MAPK1 P28482 2/20 0.34
RAB9A P51151 2/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
BLM P54132 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSP90AA1 P07900 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
SCHEMBL7938605 0.92 KMT2A (0.40) KMT2AGAAATMALDH1A1MEN1
SCHEMBL8153591 0.88 GAA (0.36) KMT2AGAAATMALDH1A1MEN1
SCHEMBL7932818 0.82 MAPT (0.47) KMT2AALDH1A1MEN1SMN1; SMN2NPC1
SCHEMBL7926378 0.81 ALDH1A1 (0.43) KMT2AGAAATMALDH1A1MEN1
SCHEMBL7926376 0.80 POLB (0.46) KMT2AGAAATMMEN1CYP1A2
SCHEMBL6794821 0.80 PPOX (0.44) KMT2AGAAATMALDH1A1MAPK1
SCHEMBL7935713 0.79 NPBWR1 (0.34) KMT2AGAAATMALDH1A1MEN1
SCHEMBL7532202 0.77 PPOX (0.44) KMT2AGAAATMMEN1CYP1A2
SCHEMBL7020290 0.74 BCAT1 (0.37) KMT2AGAAATMBLMCHRM5
SCHEMBL5388413 0.73 GAA (0.37) KMT2AGAAATMALDH1A1L3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6303543-B1 Diaryl ethers and processes for their preparation and herbicidal and desiccant compositions containing them ISHIHARA SANGYO KAISHA, LTD. (JP) 2001-10-16 US disclosed
US-6121201-A HETEROARYL SUBSTITUTED HALO-PYRAZOLE SUBSTITUTED DIARYL ETHERS OR THIOETHERS ISHIHARA SANGYO KAISHA, LTD. (JP) 2000-09-19 US disclosed