SCHEMBL851589

SCHEMBL851589

NC(=O)c1cc(C(F)(F)C(F)(F)C(F)(F)F)ncn1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.37
CA2 P00918 1/20 0.34
CHKA P35790 1/20 0.34
GRM2 Q14416 5/20 0.32
LMNA P02545 1/20 0.32
SCN9A Q15858 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
TSHR P16473 1/20 0.31
MC4R P32245 1/20 0.31
ADRA1A P35348 1/20 0.31
MC3R P41968 1/20 0.31
KMO O15229 2/20 0.31
PARP1 P09874 1/20 0.31
LCK P06239 1/20 0.30
SIRT6 Q8N6T7 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
SCHEMBL28051788 0.82 CA2 (0.52) KMT2ACA2CHKAGRM2LMNA
SCHEMBL604496 0.81 CA2 (0.33) CA2CHKA
SCHEMBL10223637 0.81 CA2 (0.33) CA2CHKA
SCHEMBL24714018 0.75 CDK8 (0.43) KMT2ALMNAADORA3TSHRMC4R
SCHEMBL642254 0.73 LMNA (0.52) KMT2ALMNAADORA3TSHRMC4R
SCHEMBL601141 0.73 CA2 (0.35) CA2CHKA
Hydrochloric Acid SCHEMBL30527997 0.71 LMNA (0.50) KMT2ALMNAADORA3TSHRMC4R
SCHEMBL10223568 0.70 CA2 (0.34) CA2CHKA
SCHEMBL600884 0.70 CA2 (0.34) CA2CHKA
SCHEMBL18422608 0.68 CA2 (0.47) CA2CHKAKMO

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
EP-2432780-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2012-03-28 EP disclosed
WO-2010134478-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 WO disclosed