SCHEMBL9734857

SCHEMBL9734857

CC(CO)Oc1cc(N)c(F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.36
ITK Q08881 2/20 0.36
NPC1 O15118 1/20 0.36
ALOX5AP P20292 4/20 0.34
FEN1 P39748 4/20 0.34
PPOX P50336 3/20 0.33
CSNK2A1 P68400 2/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
S1PR1 P21453 1/20 0.32
BRAF P15056 1/20 0.31

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
SCHEMBL8599131 0.86 SLC2A1 (0.39) NPC1PPOXCSNK2A1GAA
SCHEMBL9735484 0.85 NPC1 (0.52) NPC1CSNK2A1GAALMNABRAF
SCHEMBL4678114 0.82 PPOX (0.45) NPC1ALOX5APFEN1PPOXCSNK2A1
SCHEMBL9769674 0.81 MAOA (0.36) NPC1PPOXCSNK2A1GAA
SCHEMBL8879333 0.79 NPC1 (0.43) NPC1PPOXCSNK2A1GAA
SCHEMBL10535978 0.78 TSHR (0.42) EGFRITKCSNK2A1GAALMNA
SCHEMBL8602961 0.77 ALDH1A1 (0.47) PPOXGAAKMT2A
SCHEMBL29278731 0.77 ALDH1A1 (0.47) PPOXGAAKMT2A
SCHEMBL10811265 0.76 NPC1 (0.38) NPC1PPOXGAAMEN1LMNA
SCHEMBL8603213 0.76 PPOX (0.56) NPC1PPOXGAAMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5169428-A Tetrahydrophthalimide derivative and herbicide composition containing same TOSOH CORPORATION (JP) 1992-12-08 US disclosed
EP-0323271-A1 Tetrahydrophthalimide derivative and herbicide composition containing the same Tosoh Corporation (JP) 1989-07-05 EP disclosed