SCHEMBL8612924

SCHEMBL8612924

COC(=O)CSc1cc(N=c2[nH]n(C=O)c(=O)s2)c(F)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPOX P50336 3/20 0.32
KMT2A Q03164 4/20 0.31
POLB P06746 2/20 0.31
PRNP P04156 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
MAPT P10636 2/20 0.31
ALDH1A1 P00352 2/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 2/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
GAA P10253 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
SCHEMBL9048928 1.00 PPOX (0.32) PPOXKMT2APOLBPRNPRXFP1
SCHEMBL9048584 0.83
SCHEMBL8611325 0.83
SCHEMBL8612176 0.81 ALDH1A1 (0.34) PPOXKMT2APOLBPRNPRXFP1
SCHEMBL8612174 0.81 ALDH1A1 (0.34) PPOXKMT2APOLBPRNPRXFP1
SCHEMBL9615478 0.76 PPOX (0.33) PPOXKMT2APOLBPRNPRXFP1
SCHEMBL9048297 0.76 KMT2A (0.33) PPOXKMT2APOLBPRNPRXFP1
SCHEMBL9048292 0.76 KMT2A (0.33) PPOXKMT2APOLBPRNPRXFP1
Fluthiacetmethyl SCHEMBL29405302 0.76 KMT2A (0.35) PPOXKMT2APOLBPRNPRXFP1
Fluthiacetmethyl SCHEMBL8437784 0.76 KMT2A (0.35) PPOXKMT2APOLBPRNPRXFP1

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-5705651-A Process for producing a 3,4-alkylene-1,3,4-thiadiazolidin-2-one and intermediates for the same MITSUBISHI CHEMICAL CORPORATION (JP) 1998-01-06 US disclosed
EP-0698604-A1 Process for producing a 3,4,-alkylene-1,3,4-thiadiazolidin-2-one and intermediates for the same Mitsubishi Chemical Corporation (JP) 1996-02-28 EP disclosed