SCHEMBL3382175

SCHEMBL3382175

FC(F)(F)c1cc(Cl)n[c]n1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.31
CA2 P00918 1/20 0.30
CHKA P35790 1/20 0.30
SMARCA2 P51531 1/20 0.30
SMARCA4 P51532 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL895697 0.83 CA2 (0.36) CA2CHKAALDH1A1
SCHEMBL2116936 0.74
SCHEMBL15094424 0.73 CA2 (0.48) CA2CHKAKDM4EALDH1A1HSD17B10
SCHEMBL18938658 0.69
SCHEMBL3381842 0.68 GAA (0.40) KDM4EALDH1A1HSD17B10
SCHEMBL16242312 0.68 KDM4E (0.33) NT5ECA2CHKAKDM4EALDH1A1
SCHEMBL1787069 0.67 PLAU (0.33) ALDH1A1
SCHEMBL3383819 0.66
SCHEMBL628056 0.65 NT5E (0.39) NT5ECA2CHKASMARCA2SMARCA4
SCHEMBL17663 0.65 CA2 (0.56) NT5ECA2CHKASMARCA2SMARCA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1364946-B1 ISOXAZOLINE DERIVATIVE AND HERBICIDE COMPRISING THE SAME AS ACTIVE INGREDIENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2010-11-24 EP disclosed
EP-2186410-A1 Isoxazoline derivative and herbicide comprising the same as active ingredient KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-05-19 EP disclosed
US-7238689-B2 Isoxazoline derivative and herbicide comprising the same as active ingredient IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2007-07-03 US disclosed