SCHEMBL5654748

SCHEMBL5654748

O=C=NS(=O)(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
APEX1 P27695 1/20 0.42
FLT1 P17948 2/20 0.38
FLT4 P35916 2/20 0.38
KDR P35968 2/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
CCR2 P41597 1/20 0.38
F2 P00734 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
NFE2L2 Q16236 1/20 0.36
PTGES2 Q9H7Z7 1/20 0.36
RAB9A P51151 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36

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
SCHEMBL5652756 0.85 F2 (0.36) MAPK1TDP1APEX1F2PRSS1
SCHEMBL5655635 0.84 TDP1 (0.38) MAPK1TDP1APEX1F2PRSS1
SCHEMBL10717112 0.80 ALDH1A1 (0.54) MAPK1MAPTALDH1A1LMNA
SCHEMBL5653955 0.79 F2 (0.37) F2PRSS1PRSS2PRSS3MAPT
SCHEMBL1125078 0.78 F2 (0.52) MAPK1TDP1F2PRSS1PRSS2
SCHEMBL8470065 0.77 MAPK1 (0.59) MAPK1TDP1F2PRSS1PRSS2
SCHEMBL5655910 0.77 MAPK1 (0.51) MAPK1TDP1F2PRSS1PRSS2
SCHEMBL8854126 0.76 PGR (0.45) NFE2L2ALDH1A1PGR
SCHEMBL5652655 0.75 CA2 (0.44) TDP1F2PRSS1PRSS2PRSS3
SCHEMBL5655158 0.74 F2 (0.31) MAPK1F2PRSS1PRSS2PRSS3

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 25 patents — showing the first 20. 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-0721944-B1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LTD (JP) 2001-01-17 EP disclosed
EP-1054029-A1 Method of improving stability of aromatic polycarbodimides ROHM AND HAAS COMPANY (US) 2000-11-22 EP disclosed
CN-1273980-A Method of improving stability of aromatic polycarbodi-imide ROHM & HAAS (US) 2000-11-22 CN disclosed
US-5691335-A CARDIOVASCULAR DISORDERS SUNTORY LIMITED (JP) 1997-11-25 US disclosed
EP-0721944-A1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LIMITED (JP) 1996-07-17 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-0172379-B1 MATERIAL FOR ORTHOPAEDIC BANDAGES BAYER AG (DE) 1989-04-19 EP disclosed
US-4804655-A Pesticidal cyclic malonylphosphonic diamides BAYER AKTIENGESELLSCHAFT (DE) 1989-02-14 US 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-0240716-A2 Bicyclic diazaphosphorus compounds, process for their preparation and their use as pesticides BAYER AG (DE) 1987-10-14 EP disclosed
EP-0231512-A1 Cyclic malonylphosphonic acid diamides, process for their preparation and their use for pestcontrol BAYER AG (DE) 1987-08-12 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-0173252-A2 Process for the preparation of oligomeric polyisocyanates and their use in the preparation of polyurethane plastics BAYER AG (DE) 1986-03-05 EP disclosed
EP-0172379-A1 Material for orthopaedic bandages BAYER AG (DE) 1986-02-26 EP disclosed
EP-0132675-A2 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) 1985-02-13 EP disclosed