SCHEMBL8960197

SCHEMBL8960197

CCc1c(C(F)(F)F)ncn(-c2ccc(F)cc2F)c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
HCAR1 Q9BXC0 2/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
GLA P06280 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
UGCG Q16739 1/20 0.34
LMNA P02545 1/20 0.34
GRM5 P41594 1/20 0.33
GRM1 Q13255 1/20 0.33
CYP17A1 P05093 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 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
SCHEMBL8960193 0.83 HCAR1 (0.42) MAPK11MAPK14HCAR1ESR1ESR2
SCHEMBL8960483 0.76 GLA (0.41) KDM5BL3MBTL1GLAUGCGLMNA
SCHEMBL8960113 0.73 NR3C2 (0.41) KDM5B
SCHEMBL8960285 0.68 ESR1 (0.38) HCAR1ESR1ESR2LMNAGRM5
SCHEMBL8279156 0.64 ESR1 (0.46) MAPK11MAPK14ESR1ESR2L3MBTL1
SCHEMBL27397705 0.64 KDM5B (0.43) KDM5BGLALMNA
SCHEMBL10027269 0.64 ESR1 (0.46) ESR1ESR2L3MBTL1GLAGRM1
SCHEMBL8960198 0.63 GLA (0.46) MAPK11MAPK14KDM5BL3MBTL1GLA
SCHEMBL9412140 0.62 GRM5 (0.42) HCAR1ESR1ESR2GABRG2GABRB3
SCHEMBL10027242 0.62 ESR2 (0.41) MAPK11MAPK14HCAR1ESR1ESR2

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
US-5532208-A HERBICIDES SUMITOMO CHEMICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5366955-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0568041-A1 Pyrimidone derivatives and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-03 EP disclosed