SCHEMBL9735463

SCHEMBL9735463

FC(F)(F)c1c[nH]c(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GUSB P08236 1/20 0.40
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CXCR2 P25025 4/20 0.39
HSD11B1 P28845 2/20 0.38
ALDH1A1 P00352 3/20 0.36
NPBWR1 P48145 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
AHR P35869 1/20 0.36
DPP4 P27487 1/20 0.36
HPGD P15428 3/20 0.35
GAA P10253 2/20 0.35
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL25975033 0.85 NT5E (0.47) HSD11B1KDM4EHPGD
SCHEMBL3586547 0.81 ALDH1A1 (0.44) GUSBPTGS1PTGS2CXCR2HSD11B1
SCHEMBL8178007 0.80 CNR1 (0.40) GUSBPTGS1PTGS2HSD11B1ALDH1A1
SCHEMBL27731900 0.77 KDM4E (0.45) PTGS1PTGS2ALDH1A1KDM4EHPGD
SCHEMBL7144947 0.77 HSP90AA1 (0.47) GUSBCXCR2HSD11B1NPBWR1HSP90AA1
SCHEMBL31254967 0.76 ALDH1A1 (0.44) ALDH1A1KDM4EHTTLMNAKMT2A
SCHEMBL27663798 0.75 GAA (0.46) PTGS1PTGS2CXCR2ALDH1A1KDM4E
SCHEMBL5442233 0.74 IDO1 (0.36) ALDH1A1KDM4EGAAHSD17B10
SCHEMBL27933325 0.74 DGAT1 (0.35)
SCHEMBL3803127 0.72 JAK2 (0.36) GUSBALDH1A1KDM4EAHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992007835-A1 IMIDAZOLE FUNGICIDES SCHERING AGROCHEMICALS LIMITED (GB) 1992-05-14 WO disclosed