SCHEMBL8485658

SCHEMBL8485658

CSc1cc(N=C=O)c(F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.33
MAPK1 P28482 1/20 0.33
CYP3A4 P08684 3/20 0.32
TRPA1 O75762 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL8603166 0.83
SCHEMBL8484124 0.83 MAPK1 (0.31) TDP1MAPK1
SCHEMBL1100652 0.80 TDP1 (0.33) TDP1MAPK1CYP3A4TRPA1ALDH1A1
SCHEMBL7931545 0.80 TDP1 (0.45) TDP1MAPK1CYP3A4TRPA1ALDH1A1
SCHEMBL10347965 0.78 TDP1 (0.39) TDP1MAPK1CYP3A4TRPA1ALDH1A1
SCHEMBL8486447 0.78
SCHEMBL9836795 0.77 CYP3A4 (0.42) TDP1MAPK1CYP3A4TRPA1ALDH1A1
SCHEMBL8487776 0.77 HTR2A (0.30)
SCHEMBL8481186 0.76
SCHEMBL8485879 0.76 CA12 (0.34)

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-5883049-A Hydantoin derivatives and herbicides containing said derivatives as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1999-03-16 US disclosed
EP-0801068-A1 HYDANTOIN DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND HERBICIDES COMPRISING THE SAME AS ACTIVE INGREDIENTS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1997-10-15 EP disclosed