SCHEMBL4894480

SCHEMBL4894480

Cc1scc(C(=O)N(C)C)c1S(N)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32
KEAP1 Q14145 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
GSK3B P49841 1/20 0.30
HPGD P15428 2/20 0.30
ENPP2 Q13822 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
SCHEMBL27444582 0.81 TSHR (0.37) CA2CA12CA1CA9L3MBTL1
SCHEMBL5797600 0.80 CA2 (0.33) CA2
SCHEMBL3212068 0.77 CA2 (0.46) CA2CA12CA1CA9KMT2A
SCHEMBL3211322 0.74 CA12 (0.45) CA2CA12CA1CA9MEN1
SCHEMBL3215200 0.73 CA12 (0.41) CA2CA12CA1CA9HPGD
SCHEMBL4901107 0.73 CA2 (0.42) CA2CA12CA1CA9KMT2A
SCHEMBL14100165 0.73 SMN1; SMN2 (0.35) KEAP1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL3216663 0.71 ALDH1A1 (0.45) CA2CA12CA1CA9L3MBTL1
SCHEMBL6150867 0.70 CA2 (0.33) CA2CA12CA1CA9
SCHEMBL6733242 0.70 CA2 (0.33) CA2CA12CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100475040-C Aminocarbonyl-substituted thienylsulfonylamino (thio) carbonyltriazolin (thi) ones, process for their preparation and their use BAYER CROPSCIENCE AG (DE) 2009-04-08 CN disclosed
US-20080171662-A1 Aminocarbonyl-Substituted Thiensulfonylamino(Thio)Carbonyl-Triazolin(Ethi)Ones, Processes For Their Preparation And Their Use BAYER CROPSCIENCE AG (DE) 2008-07-17 US disclosed
US-20080171662-A1 Aminocarbonyl-Substituted Thiensulfonylamino(Thio)Carbonyl-Triazolin(Ethi)Ones, Processes For Their Preparation And Their Use BAYER CROPSCIENCE AG (DE) 2008-07-17 US disclosed
US-20080171662-A1 Aminocarbonyl-Substituted Thiensulfonylamino(Thio)Carbonyl-Triazolin(Ethi)Ones, Processes For Their Preparation And Their Use BAYER CROPSCIENCE AG (DE) 2008-07-17 US disclosed
CN-1984564-A Aminocarbonyl-substituted thienylsulfonylamino (thio) carbonyltriazolin (thi) ones, process for their preparation and their use BAYER CROPSCIENCE AG (DE) 2007-06-20 CN disclosed
EP-1776012-A1 AMINOCARBONYL-SUBSTITUTED THIENSULPHONYLAMINO (THIO) CARBONYLTRIAZOLIN (THI) ONES METHODS FOR PRODUCTION AND USE THEREOF Bayer CropScience Aktiengesellschaft (DE) 2007-04-25 EP disclosed
WO-2006012983-A1 AMINOCARBONYL-SUBSTITUTED THIENSULPHONYLAMINO (THIO) CARBONYLTRIAZOLIN (THI) ONES METHODS FOR PRODUCTION AND USE THEREOF BAYER CROPSCIENCE AG (DE) 2006-02-09 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 (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-20080171662-A1 Aminocarbonyl-Substituted Thiensulfonylamino(Thio)Carbonyl-Triazolin(Ethi)Ones, Processes For Their Preparation And Their Use TST, SULT1E1, CBR3 CA2 1518/4885CA12 4441/4885CA1 3548/4885

“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.