SCHEMBL8960266

SCHEMBL8960266

Cc1c(C(F)(F)F)ncn(-c2cc([N+](=O)[O-])c(F)cc2F)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ESPL1 Q14674 1/20 0.34
HCAR1 Q9BXC0 1/20 0.34
GAA P10253 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM5B Q9UGL1 1/20 0.32
ATM Q13315 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8960340 0.77 PLA2G4B (0.35) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL8960193 0.76 HCAR1 (0.42) POLBHCAR1LMNAKDM5B
SCHEMBL8960163 0.76 HCAR1 (0.37) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL9723126 0.74 TDP1 (0.44) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL9581636 0.71 ALDH1A1 (0.38) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL22467860 0.69 MAPT (0.35) ALDH1A1KDM4EESPL1GAAMAPT
SCHEMBL9582315 0.69 POLB (0.39) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL8960446 0.69 CNR2 (0.30)
SCHEMBL8960030 0.68 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AHCAR1MAPT
SCHEMBL7038526 0.66 ESPL1 (0.35) ALDH1A1KDM4EKMT2AESPL1GAA

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