SCHEMBL8564686

SCHEMBL8564686

Cn1nc(-c2cc([O])c(Cl)cc2F)c(Cl)c1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
NOTUM Q6P988 1/20 0.33
HSD11B1 P28845 1/20 0.32
SLC34A1 Q06495 2/20 0.32
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL8570221 0.84 MEN1 (0.37) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7524976 0.84 CYP1A2 (0.39) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL30130322 0.84 CYP1A2 (0.39) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL8566222 0.84 MEN1 (0.38) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL27322874 0.83 MEN1 (0.36) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7615238 0.83 MEN1 (0.36) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL6289041 0.83 MEN1 (0.36) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7591106 0.83 MEN1 (0.34) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL30130330 0.83 MEN1 (0.34) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7960684 0.82 NTRK1 (0.35) MEN1CYP1A2CYP2C9CYP2C19KMT2A

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-0553307-B1 HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES MONSANTO CO (US) 1998-12-09 EP claimed