SCHEMBL9856780

SCHEMBL9856780

CCOC(=O)C(C)Sc1cc(-c2nn(C)c(OC(F)F)c2Cl)c(F)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPOX P50336 5/20 0.34
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 4/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 2/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALOX15 P16050 1/20 0.33
GAA P10253 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 2/20 0.31
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 2/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL9856906 0.93 PPOX (0.35) PPOXALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9857079 0.92 ALDH1A1 (0.33) ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL27469166 0.84 PPOX (0.32) PPOXKDM4ELMNARAB9ANPC1
SCHEMBL9857029 0.84 ALDH1A1 (0.34) ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6295364 0.83 PPOX (0.46) PPOXALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9856794 0.82 BAZ2B (0.40) KDM4EHPGDLMNAMAPTGAA
SCHEMBL9856747 0.81 PPOX (0.35) PPOXHPGDLMNAMAPTGAA
SCHEMBL7892359 0.80 CYP3A4 (0.32) PPOXKDM4ERAB9ANPC1SMN1; SMN2
Pyraflufen-Ethyl SCHEMBL53390 0.79 PPOX (0.44) PPOXALDH1A1KDM4EHPGDHSD17B10
Pyraflufen-Ethyl SCHEMBL29480904 0.79 PPOX (0.44) PPOXALDH1A1KDM4EHPGDHSD17B10

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