SCHEMBL7029049

SCHEMBL7029049

COc1csc(C(=O)OC(C)C)c1.O=C=NS(=O)(=O)N=C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 4/20 0.33
MAPK1 P28482 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
HPGD P15428 3/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
FLT3 P36888 4/20 0.33
PRKCI P41743 1/20 0.33
PRKCZ Q05513 1/20 0.33
GAA P10253 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 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
SCHEMBL7031481 0.87 CTPS1 (0.39) MEN1KMT2AALDH1A1MAPK1L3MBTL1
SCHEMBL7030226 0.87 ABL1 (0.34)
SCHEMBL7030948 0.87
SCHEMBL7025330 0.85 DAO (0.41) MEN1KMT2AALDH1A1MAPK1HPGD
SCHEMBL7033439 0.85 CES2 (0.39) MEN1KMT2AALDH1A1MAPK1HPGD
SCHEMBL7024257 0.84 CA12 (0.32) MAPTPOLBCA12CA1CA2
SCHEMBL7033124 0.84 MELK (0.33) MAPTPOLBCA12CA1CA2
SCHEMBL7024177 0.82 HPGD (0.37) MEN1KMT2AALDH1A1MAPK1L3MBTL1
SCHEMBL7031595 0.82 HPGD (0.35) ALDH1A1MAPK1HPGDMAPTHSD17B10
SCHEMBL7032161 0.81 CA12 (0.31) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030162979-A1 Substituted sulphonylamino(thio)carbonyl compounds MULLER KLAUS-HELMUT (DE) 2003-08-28 US disclosed
US-6441195-B1 2-ALKOXYCARBONYL-3-SULPHONAMIDE, SULPHONYL ISOCYANATE OR SULPHONYL ISOTHIOCYANATE-THIOPHENES; PRE- OR POSTEMERGENCE HERBICIDES; EFFICIENCY BAYER AKTIENGESELLSCHAFT (DE) 2002-08-27 US disclosed
US-6180567-B1 REACTING 2-ALKOXYCARBONYL-BENZENESULFONAMIDE DERIVATIVE WITH 1,2,4-(1H)TRIAZOLE-5-(THI)ONE DERIVATIVE BAYER AKTIENGESELLSCHAFT (DE) 2001-01-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030162979-A1 Substituted sulphonylamino(thio)carbonyl compounds CBR3, CTH, CBR1 MEN1 4546/4885KMT2A 2161/4885ALDH1A1 261/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.