SCHEMBL9835474

SCHEMBL9835474

CC(C)(C)Oc1cc(N=C=O)c(Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
MAPK1 P28482 1/20 0.38
CYP3A4 P08684 3/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TRPA1 O75762 1/20 0.36

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
SCHEMBL9836900 0.82 ALDH1A1 (0.51) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL9529407 0.78 TDP1 (0.39) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL9835490 0.78 KDM4E (0.39) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL1493025 0.77 TDP1 (0.52) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL7159670 0.75 ALDH1A1 (0.56) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL1457032 0.75 TDP1 (0.56) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL1493000 0.74 TDP1 (0.48) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL8485314 0.74 CUL4A (0.44) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL13019830 0.72 LMNA (0.39) TDP1MAPK1ALDH1A1HPGD
SCHEMBL9530684 0.72 LMNA (0.43) TDP1MAPK1CYP3A4ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed