SCHEMBL163890

SCHEMBL163890

S=C(Oc1ccccc1)SCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA9 Q16790 2/20 0.53
IDO1 P14902 9/20 0.47
NOS3 P29474 1/20 0.47
NOS1 P29475 1/20 0.47
NOS2 P35228 1/20 0.47
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL2741391 0.88 CA12 (0.46) CA12CA1CA2CA9IDO1
SCHEMBL22267384 0.84 ELANE (0.49) CA12CA1CA2CA9TDP1
SCHEMBL27918265 0.83 NOS1 (0.47) CA12CA1CA2CA9IDO1
SCHEMBL22267270 0.81 ELANE (0.55)
SCHEMBL1524413 0.79 CA12 (0.47) CA12CA1CA2CA9IDO1
SCHEMBL15456955 0.78 NOS3 (0.42) NOS3NOS1NOS2HDAC3HDAC4
SCHEMBL10921071 0.78 CA12 (0.55) CA12CA1CA2CA9IDO1
SCHEMBL22267292 0.78 LIPG (0.46) CA1CA2CA9
SCHEMBL3063093 0.77 CA12 (0.53) CA12CA1CA2CA9IDO1
SCHEMBL2364066 0.76 CA12 (0.52) CA12CA1CA2CA9IDO1

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 109 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077928-A1 Polymerization using a diallylamine and a compound comprising a macromolecular chain comprising units derived from this amine RHODIA OPERATIONS (FR) 2012-03-29 US claimed
US-20100093929-A1 Polymerization Of Macromolecular Monomers Comprising Diallyamine Structual Units RHODIA OPERATIONS (FR) 2010-04-15 US claimed
EP-2038318-A2 POLYMERISATION FROM A DIALLYLAMINE AND A COMPOUND CONTAINING A MACROMOLECULAR CHAIN CONSISTING OF UNITS DERIVED FROM SUCH AN AMINE Rhodia Opérations (FR) 2009-03-25 EP claimed
WO-2008000766-A2 POLYMERISATION FROM A DIALLYLAMINE AND A COMPOUND CONTAINING A MACROMOLECULAR CHAIN CONSISTING OF UNITS DERIVED FROM SUCH AN AMINE RHODIA OPERATIONS (FR) 2008-01-03 WO claimed
EP-2292668-B2 Process for preparing polymers and compositions thereof LUBRIZOL CORP (US) 2025-09-10 EP disclosed
CN-117729949-A Intermittent catheter 康沃特克有限公司 2024-03-19 CN disclosed
CN-117729948-A Intermittent catheter 康沃特克有限公司 2024-03-19 CN disclosed
WO-2024052192-A1 FLUOROPOLYMER MEDICAL DEVICES UNOMEDICAL A/S (DK) 2024-03-14 WO disclosed
WO-2024052193-A1 MEDICAL DEVICES UNOMEDICAL A/S (DK) 2024-03-14 WO disclosed
EP-3408016-B1 POLYMERIC DISPERSANTS CONTAINING MULTI-AMINE GROUPS WITH IMPROVED CHEMICAL AND THERMAL STABILITY LUBRIZOL ADVANCED MAT INC (US) 2023-11-22 EP disclosed
EP-3101096-B1 METHOD OF LUBRICATION OF TURBINES USING STAR POLYMERS LUBRIZOL CORP (US) 2023-08-16 EP disclosed
CN-110997882-B Lubricating composition containing self-assembled polymethacrylate block copolymer and ethylene-alpha-olefin copolymer 路博润公司 2023-08-08 CN disclosed
EP-1833868-A2 STAR POLYMERS AND COMPOSITIONS THEREOF THE LUBRIZOL CORPORATION (US) 2007-09-19 EP disclosed
EP-1054906-B1 POLYMERIZATION PROCESS WITH LIVING CHARACTERISTICS AND POLYMERS MADE THEREFROM DU PONT (US) 2006-11-22 EP disclosed
WO-2006047398-A2 STAR POLYMERS AND COMPOSITIONS THEREOF THE LUBRIZOL CORPORATION (US) 2006-05-04 WO disclosed
US-6747111-B2 POLYMERS HAVING LOW POLLYDISPERSITY AND PREDICTABLE SPECIFIC POLYMER ARCHITECTURE AND MOLECULAR WEIGHT ARE PRODUCED BY THE PROCESS. THE POLYMERS PRODUCED BY THE PROCESS ARE SUITABLE FOR USE AS BINDERS IN AUTOMOTIVE OEM AND REFINISH COATINGS. E. I. DU PONT DE NEMOURS AND COMPANY 2004-06-08 US disclosed
US-20040024132-A1 Polymerization process with living characteristics and polymers made therefrom COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2004-02-05 US disclosed
US-6642318-B1 Sulfur based chain transfer agents; widely compatible; free radical polymerization; producing low polydispersity and predictably specific architecture E. I. DU PONT DE NEMOURS AND COMPANY 2003-11-04 US disclosed
EP-1054906-A1 POLYMERIZATION PROCESS WITH LIVING CHARACTERISTICS AND POLYMERS MADE THEREFROM E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-11-29 EP disclosed
WO-1999031144-A1 POLYMERIZATION PROCESS WITH LIVING CHARACTERISTICS AND POLYMERS MADE THEREFROM E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-06-24 WO disclosed