SCHEMBL8620177

SCHEMBL8620177

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
GRIN2B Q13224 2/20 0.32
GRIN1 Q05586 1/20 0.32
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31
ESR1 P03372 1/20 0.31
POLB P06746 1/20 0.31
ESR2 Q92731 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
ERBB2 P04626 2/20 0.31
KCNH2 Q12809 2/20 0.31
EGFR P00533 1/20 0.31
CYP1A2 P05177 1/20 0.30
GLA P06280 1/20 0.30
CYP3A4 P08684 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
SCHEMBL8620077 0.89 CYP2C9 (0.32) CYP2C9CYP2C19LMNA
SCHEMBL9856871 0.85 PPOX (0.41) CYP2C9CYP2C19LMNAHTTTDP1
SCHEMBL9857238 0.80 KDM4E (0.36) HPGD
SCHEMBL9857297 0.80 PPOX (0.36) LMNA
SCHEMBL9857265 0.78 TDP1 (0.38) CYP2C9CYP2C19LMNAESR1POLB
SCHEMBL9856765 0.78 LMNA (0.49) LMNAHTTPOLBTDP1HPGD
SCHEMBL6295364 0.77 PPOX (0.46) LMNAHTTTDP1HPGD
SCHEMBL7829990 0.77 TSHR (0.34) POLB
SCHEMBL8183820 0.77 NTRK1 (0.30)
SCHEMBL9857078 0.76 GAA (0.42) LMNAESR1POLBTDP1HPGD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0443059-B1 3-(Substituted phenyl)pyrazole derivatives, salts thereof, herbicides therefrom, and process for producing said derivatives or salts NIHON NOHYAKU CO LTD (JP) 1998-06-17 EP disclosed
EP-0361114-B1 3-(Substituted phenyl) pyrazole derivatives, salts thereof, herbicides therefrom, and process for producing said derivatives or salts NIHON NOHYAKU CO LTD (JP) 1998-06-03 EP disclosed
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 disclosed
US-5032165-A 3-(substituted phenyl)pyrazole derivatives, salts thereof, and herbicides therefrom NIHON NOHYAKU COMPANY, LTD. (JP) 1991-07-16 US disclosed
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 disclosed