SCHEMBL4284829

SCHEMBL4284829

CCc1nc(C(F)(F)F)c(C)c(=O)n1C

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 2/20 0.42
CASR P41180 1/20 0.38
GAK O14976 1/20 0.33

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
SCHEMBL4291653 0.79 KDM5B (0.40) KDM5B
SCHEMBL4283815 0.78 KDM5B (0.46) KDM5BCASR
SCHEMBL4295087 0.77 KDM5B (0.43) KDM5BCASR
Iodomethane SCHEMBL4286519 0.75 KDM5B (0.44) KDM5BCASR
SCHEMBL4287126 0.72 KDM5B (0.42) KDM5BCASR
SCHEMBL26173957 0.67 ALDH1A1 (0.33)
SCHEMBL4282510 0.66 CASR (0.41) KDM5BCASR
SCHEMBL4283741 0.63 L3MBTL1 (0.41) KDM5B
SCHEMBL18850832 0.63 KDM4E (0.36)
SCHEMBL13377102 0.62 KDM5B (0.42) KDM5BCASR

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-2009158258-A1 HERBICIDAL DIHYDRO OXO SIX-MEMBERED AZINYL ISOXAZOLINES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-12-30 WO disclosed