SCHEMBL3405047

SCHEMBL3405047

CCCCSc1ccc(C=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
HPGD P15428 6/20 0.44
MAPT P10636 5/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SLC2A1 P11166 1/20 0.44
ALDH3A1 P30838 1/20 0.42
ALDH1A3 P47895 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
XDH P47989 1/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41

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
SCHEMBL11311491 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL11317920 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL3844526 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL11437314 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL11166359 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL11440269 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL6689838 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL11309662 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL10401962 0.93 THRB (0.49) ALDH1A1MAOAMAOBHPGDMAPT
SCHEMBL8595279 0.88 ALDH1A1 (0.54) ALDH1A1MAOAMAOBHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2236488-A1 Materials, methods and uses for photochemical generation of acids and/or radical species The Arizona Board of Regents on behalf of the University of Arizona (US) 2010-10-06 EP disclosed
US-7459106-B2 Materials, methods, and uses for photochemical generation of acids and/or radical species THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2008-12-02 US disclosed
US-7459106-B2 Materials, methods, and uses for photochemical generation of acids and/or radical species THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2008-12-02 US disclosed
EP-1390664-A4 MATERIALS, METHODS, AND USES FOR PHOTOCHEMICAL GENERATION OF ACIDS AND/OR RADICAL SPECIES UNIV ARIZONA (US) 2008-01-02 EP disclosed
WO-2007114902-A2 ALKYLTHIOBENZYLPIPERIDINE COMPOUNDS H.LUNDBECK A/S (DK) 2007-10-11 WO disclosed
US-20050173683-A1 Materials, methods, and uses for photochemical generation of acids and/or radical species THE ARIZ BD OF REGENTS ON BEHALF OF THE UNIV OF AZ (US) 2005-08-11 US disclosed
EP-1390664-A1 MATERIALS, METHODS, AND USES FOR PHOTOCHEMICAL GENERATION OF ACIDS AND/OR RADICAL SPECIES The Arizona Board of Regents (US) 2004-02-25 EP disclosed
WO-2002079691-A1 MATERIALS, METHODS, AND USES FOR PHOTOCHEMICAL GENERATION OF ACIDS AND/OR RADICAL SPECIES THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2002-10-10 WO disclosed
EP-0572712-B1 Processes for producing 2-substituted benzo(beta)thiophene SUMITOMO SEIKA CHEMICALS (JP) 1998-01-21 EP disclosed
US-5298630-A Reacting 2-alkylthiobenzaldehyde derivative with halo compound SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1994-03-29 US disclosed
EP-0572712-A2 Processes for producing 2-substituted benzo(beta)thiophene SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1993-12-08 EP disclosed
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 EP disclosed
EP-0082694-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1986-07-16 EP disclosed
US-4555263-A OXIME COMPOUNDS ICI AUSTRALIA LIMITED (AU) 1985-11-26 US disclosed
EP-0082694-A2 Herbicidal cyclohexane-1,3-dione derivatives ICI AUSTRALIA LIMITED (AU) 1983-06-29 EP disclosed
US-4087549-A Sulphonic acid containing indenyl derivatives MERCK & CO., INC. (US) 1978-05-02 US disclosed
US-4058563-A Novel schiff bases THE UPJOHN COMPANY (US) 1977-11-15 US disclosed
US-4026943-A Novel process THE UPJOHN COMPANY (US) 1977-05-31 US disclosed
US-4020104-A Process for isomerizing cis,cis- and cis,trans-isomers of di-(p-aminocyclohexyl)methane to the corresponding trans,trans-isomer THE UPJOHN COMPANY (US) 1977-04-26 US disclosed
US-3956395-A Distyrylbenzene disulfone derivatives MEYER HANS RUDOLF 1976-05-11 US disclosed