SCHEMBL3211322

SCHEMBL3211322

CCOC(=O)c1csc(C)c1S(N)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.45
CA9 Q16790 6/20 0.45
CA1 P00915 5/20 0.45
CA2 P00918 5/20 0.45
TSHR P16473 1/20 0.43
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
STS P08842 1/20 0.41
CA7 P43166 2/20 0.41
CA14 Q9ULX7 2/20 0.41
FHIT P49789 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL3216663 0.90 ALDH1A1 (0.45) CA12CA9CA1CA2TSHR
SCHEMBL3205561 0.86 CA1 (0.44) CA12CA9CA1CA2TSHR
SCHEMBL4373945 0.86 CA1 (0.47) CA12CA9CA1CA2TSHR
SCHEMBL3207148 0.85 CA1 (0.49) CA12CA9CA1CA2TSHR
SCHEMBL3218236 0.84 TSHR (0.43) CA12CA9CA1CA2TSHR
SCHEMBL3212068 0.84 CA2 (0.46) CA12CA9CA1CA2TSHR
SCHEMBL3206602 0.84 CA1 (0.45) CA12CA9CA1CA2TSHR
SCHEMBL3205576 0.84 CA1 (0.42) CA12CA9CA1CA2TSHR
SCHEMBL27477316 0.84 CA1 (0.42) CA12CA9CA1CA2TSHR
SCHEMBL3215200 0.80 CA12 (0.41) CA12CA9CA1CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7858805-B2 Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(ethi)ones BAYER AKTIENGESELLSCHAFT (DE) 2010-12-28 US disclosed
US-20100056798-A1 Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(ethi)ones BAYER CROPSCIENCE AG (DE) 2010-03-04 US disclosed
US-7642221-B2 herbicides; preparation from chemical intermediates; treating the crops BAYER AKTIENGESELLSCHAFT (DE) 2010-01-05 US disclosed
US-7625841-B2 Substituted thiene-3-ylsulphonylamino(thio)carbonyltriazolin(ethi)ones BAYER CROPSCIENCE AG (DE) 2009-12-01 US disclosed
EP-1443822-B1 SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES BAYER CROPSCIENCE AG (DE) 2008-12-17 EP disclosed
US-20080269061-A1 Substituted thiene-3-ylsulphonylamino(thio)carbonyltriazolin(ethi)ones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-10-30 US disclosed
US-7410933-B2 Substituted thiene-3-ylsulphonylamino(thio)carbonyl-triazolin(thi)ones BAYER CROPSCIENCE AG (DE) 2008-08-12 US disclosed
CN-1324964-C Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(thi)ones BAYER CROPSCIENCE AG (DE) 2007-07-11 CN disclosed
US-6964939-B1 Substituted thiene-3-yl-sulfonyl amino(thio)carbonyl-triazolin(thi)ones BAYER AKTIENGESELLSCHAFT (DE) 2005-11-15 US disclosed
US-20050130843-A1 Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(ethi)ones BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-16 US disclosed
CN-1578625-A Substituted thiophen-3-yl-sulfonylamino carbonyl-triazolin (thi) ones BAYER CROPSCIENCE AG (DE) 2005-02-09 CN disclosed
US-20050014809-A1 Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(thi)ones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2005-01-20 US disclosed
EP-1443822-A1 SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES Bayer CropScience AG (DE) 2004-08-11 EP disclosed
EP-1200426-B1 SUBSTITUTED THIENE-3-YL-SULFONYL AMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES BAYER CROPSCIENCE AG (DE) 2004-02-25 EP disclosed
WO-2003037086-A1 SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES BAYER CROPSCIENCE AG (DE) 2003-05-08 WO disclosed
EP-1200426-A1 SUBSTITUTED THIENE-3-YL-SULFONYL AMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES Bayer Aktiengesellschaft (DE) 2002-05-02 EP disclosed
WO-2001005788-A1 SUBSTITUTED THIENE-3-YL-SULFONYL AMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-01-25 WO 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 (4 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-20050014809-A1 Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(thi)ones DDT, TARS2, TST CA12 4554/4885CA9 3872/4885CA1 3788/4885
US-20100056798-A1 Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(ethi)ones TST, SULT1E1, CCNE2 CA12 2976/4885CA9 3516/4885CA1 3440/4885
US-20080269061-A1 Substituted thiene-3-ylsulphonylamino(thio)carbonyltriazolin(ethi)ones DDT, NAT1, TARS2 CA12 4640/4885CA9 3870/4885CA1 3846/4885
US-20050130843-A1 Substituted thien-3-yl-sulphonylamino(thio)carbonyl-triazolin(ethi)ones TST, SULT1E1, SULT2A1 CA12 3954/4885CA9 3578/4885CA1 3277/4885

“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.