SCHEMBL9857280

SCHEMBL9857280

CC(C)OC(=O)COc1cc(-c2nn(C)c(OC(F)F)c2Cl)c(F)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.33
PPOX P50336 1/20 0.33
PTGDR Q13258 3/20 0.32
MAPT P10636 1/20 0.32
ESR1 P03372 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
POLB P06746 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
CASP1 P29466 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL9857265 0.92 TDP1 (0.38) TSHRTDP1L3MBTL1LMNAPTGDR
SCHEMBL9857318 0.90 LMNA (0.44) TSHRTDP1L3MBTL1LMNAPPOX
Pyraflufen-Ethyl SCHEMBL53390 0.89 PPOX (0.44) TSHRTDP1L3MBTL1LMNAPPOX
Pyraflufen-Ethyl SCHEMBL29480904 0.89 PPOX (0.44) TSHRTDP1L3MBTL1LMNAPPOX
SCHEMBL38952 0.88 TDP1 (0.36) TSHRTDP1LMNAPTGDRKDM4E
SCHEMBL4898211 0.88 TDP1 (0.36) TSHRTDP1LMNAPTGDRKDM4E
SCHEMBL9856861 0.87 TDP1 (0.38) TSHRTDP1L3MBTL1LMNAPPOX
SCHEMBL7128552 0.84
Pyraflufen-Ethyl SCHEMBL28092081 0.84 PPOX (0.41) TSHRTDP1L3MBTL1LMNAPPOX
SCHEMBL9870542 0.83

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-0443059-A1 3-(Substituted phenyl)pyrazole derivatives, salts thereof, herbicides therefrom, and process for producing said derivatives or salts NIHON NOHYAKU CO., LTD. (JP) 1991-08-28 EP claimed
US-5032165-A 3-(substituted phenyl)pyrazole derivatives, salts thereof, and herbicides therefrom NIHON NOHYAKU COMPANY, LTD. (JP) 1991-07-16 US claimed
EP-0361114-A1 3-(Substituted phenyl) pyrazole derivatives, salts thereof, herbicides therefrom, and process for producing said derivatives or salts NIHON NOHYAKU CO., LTD. (JP) 1990-04-04 EP claimed