SCHEMBL9856871

SCHEMBL9856871

CCOC(=O)C(C)Oc1cc(-c2nn(C)c(OC(F)F)c2Cl)c(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPOX P50336 2/20 0.41
TSHR P16473 3/20 0.34
MAPT P10636 4/20 0.33
GAA P10253 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPK1 P28482 2/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 2/20 0.32
ALOX15 P16050 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL6295364 0.92 PPOX (0.46) PPOXTSHRMAPTGAATDP1
SCHEMBL8620077 0.88 CYP2C9 (0.32) GAACYP2C9CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL9857055 0.85 BAZ2B (0.33) PPOXTSHRSMN1; SMN2LMNA
SCHEMBL9857078 0.85 GAA (0.42) PPOXTSHRMAPTGAATDP1
SCHEMBL8620177 0.85 CYP2C9 (0.33) TDP1HTTCYP2C9CYP2C19HPGD
SCHEMBL8624942 0.83 PPOX (0.40) PPOXTSHRMAPTGAATDP1
SCHEMBL9857297 0.83 PPOX (0.36) PPOXMAPTGAAL3MBTL1ALDH1A1
SCHEMBL9857284 0.82 BAZ2B (0.41) MAPTHTTALDH1A1SMN1; SMN2KMT2A
SCHEMBL6292287 0.82 CRHR1 (0.31) SMN1; SMN2LMNARORC
SCHEMBL9856906 0.82 PPOX (0.35) PPOXTSHRMAPTGAATDP1

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