SCHEMBL5655949

SCHEMBL5655949

Cc1cc(S(=O)(=O)N=C=O)ccc1S(=O)(=O)N=C=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
MMP14 P50281 1/20 0.33
ALDH1A1 P00352 3/20 0.32
PKM P14618 2/20 0.32
GAA P10253 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.31
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30
TRPA1 O75762 1/20 0.30
CYP3A4 P08684 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
SCHEMBL5654372 0.86 LMNA (0.43) LMNATDP1L3MBTL1ALDH1A1TRPA1
SCHEMBL7464876 0.85 LMNA (0.52) LMNATDP1L3MBTL1ALDH1A1PKM
SCHEMBL31259927 0.84 ALDH1A1 (0.41) LMNAMMP14ALDH1A1PKMGAA
SCHEMBL5657231 0.79 CYP3A4 (0.50) TDP1L3MBTL1ALDH1A1TRPA1CYP3A4
SCHEMBL5652756 0.79 F2 (0.36) LMNATDP1L3MBTL1F2PRSS1
SCHEMBL5653049 0.76 CYP3A4 (0.54) LMNATDP1ALDH1A1TRPA1CYP3A4
SCHEMBL5653955 0.76 F2 (0.37) LMNAALDH1A1PKMGAAF2
SCHEMBL5653136 0.76 ALDH1A1 (0.45) LMNATDP1ALDH1A1TRPA1CYP3A4
SCHEMBL395353 0.76 KMT2A (0.43) LMNATDP1L3MBTL1ALDH1A1GAA
SCHEMBL29693002 0.76 KMT2A (0.43) LMNATDP1L3MBTL1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030274-B2 Process for the production of carbodiimide modified organic isocyanates BAYER MATERIALSCIENCE LLC (US) 2006-04-18 US disclosed
US-20050282993-A1 Process for the production of carbodiimide modified organic isocyanates COVESTRO LLC 2005-12-22 US disclosed
EP-1607425-A1 Process for the production of carboiimide modified organic isocyanates Bayer MaterialScience LLC (US) 2005-12-21 EP disclosed
US-6362247-B1 DEACTIVATION PHOSPHOLENE CATALYSTS ROHM AND HAAS COMPANY 2002-03-26 US disclosed
EP-1054029-A1 Method of improving stability of aromatic polycarbodimides ROHM AND HAAS COMPANY (US) 2000-11-22 EP disclosed
US-5045226-A Reaction product of tin compound with sulfonyl isocyanate, storage stability, polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1991-09-03 US disclosed
EP-0232541-B1 POLYISOCYANATE COMPOSITIONS CONTAINING LATENT TIN-CATALYSTS, THEIR USE IN THE PREPARATION OF POLYURETHANE RESINS AND REACTION PRODUCTS OF SULFONYL ISOCYANATES WITH SELECTED TIN COMPOUNDS BAYER AG (DE) 1990-10-24 EP disclosed
EP-0173252-B1 PROCESS FOR THE PREPARATION OF OLIGOMERIC POLYISOCYANATES AND THEIR USE IN THE PREPARATION OF POLYURETHANE PLASTICS BAYER AG (DE) 1989-07-26 EP disclosed
US-4824595-A Polyisocyanate compositions containing reversibly blocked catalysts and addition products of sulfonyl isocyanates with catalysts having a tin(II)- or tin(IV)-carboxylate structure BAYER AKTIENGESELLSCHAFT (DE) 1989-04-25 US disclosed
EP-0172379-B1 MATERIAL FOR ORTHOPAEDIC BANDAGES BAYER AG (DE) 1989-04-19 EP disclosed
EP-0132675-B1 PREPARATIONS OF POLYISOCYNATE CONTAINING REVERSIBLY BLOCKED CATALYSTS, PROCESS FOR THEIR PRODUCTION, THEIR USE IN THE PRODUCTION OF POLYURETHANES, AND ADDITION PRODUCTS OF SULFONYLISOCYANATES ON CATALYSTS WITH A STRUCTURE OF CARBOXYLATES OF TIN II OR IV BAYER AG (DE) 1988-12-07 EP disclosed
EP-0232541-A2 Polyisocyanate compositions containing latent tin-catalysts, their use in the preparation of polyurethane resins and reaction products of sulfonyl isocyanates with selected tin compounds BAYER AG (DE) 1987-08-19 EP disclosed
US-4638795-A FOR MEDICAL AND VETERINARY USE; BASED ON POLYURETHANES BAYER AKTIENGESELLSCHAFT (DE) 1987-01-27 US disclosed
US-4614785-A TERTIARY PHOSPHINE OR PERALKYLATED PHOSPHORUS ACID TRIAMIDE CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1986-09-30 US disclosed
EP-0172379-A1 Material for orthopaedic bandages BAYER AG (DE) 1986-02-26 EP disclosed
US-3971740-A DYES FOR POLYESTER FIBERS CIBA-GEIGY AG (CH) 1976-07-27 US disclosed