SCHEMBL936174

SCHEMBL936174

O=C(Cl)C1=CC=CCC1=S

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL3622646 0.85
SCHEMBL6982489 0.84
SCHEMBL182009 0.83
SCHEMBL262994 0.81 PYGM (0.35)
SCHEMBL3328286 0.79
SCHEMBL7411108 0.79
SCHEMBL12609413 0.78
SCHEMBL4885755 0.78 CRHBP (0.31)
SCHEMBL15363888 0.78
SCHEMBL16014041 0.76 CRHBP (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2867230-B1 PROCESS FOR THE PREPARATION OF 3,5-DISUBSTITUTED-1,2,4-OXADIAZOLES MONSANTO TECHNOLOGY LLC (US) 2020-02-12 EP claimed
JP-5032617-A None JP disclosed
US-8772330-B2 Inhibitor(s) of transporters or uptake of monoaminergic neurotransmitters STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) 2014-07-08 US disclosed
US-20120190725-A1 INHIBITOR(S) OF TRANSPORTERS OR UPTAKE OF MONOAMINERGIC NEUROTRANSMITTERS STATE UNIVERSITY 2012-07-26 US disclosed
WO-2011011277-A1 INHIBITOR(S) OF TRANSPORTERS OR UPTAKE OF MONOAMINERGIC NEUROTRANSMITTERS STATE OF OREGON ACTING BY & THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) 2011-01-27 WO disclosed
US-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 US disclosed
EP-2144893-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2010-01-20 EP disclosed
EP-1472230-B1 ANSAMYCINS HAVING IMPROVED PHARMACOLOGICAL AND BIOLOGICAL PROPERTIES CONFORMA THERAPEUTICS CORP (US) 2009-06-17 EP disclosed
US-7507721-B2 Macrolides with antiinflammatory activity ZAMBON GROUP S.P.A. (IT) 2009-03-24 US disclosed
US-7465718-B2 Ansamycins having improved pharmacological and biological properties CONFORMA THERAPEUTICS CORPORATION (US) 2008-12-16 US disclosed
US-5281608-A Antiinflammatory agents and interleukin II antagonist AMERICAN HOME PRODUCTS CORPORATION (US) 1994-01-25 US disclosed
JP-H0532617-A PENTAFLUOROSULFANYL-FLUOROALIPHATIC CARBONYL, SULFONYL FLUORIDES AND DERIVATIVE THEREOF MINNESOTA MINING & MFG CO <3M> 1993-02-09 JP disclosed
EP-0123094-B1 A NOVEL DERIVATIVE OF BENZOIC ACID MEDEA RESEARCH S.r.l. (IT) 1988-06-22 EP disclosed
EP-0064027-B1 BENZODIOXOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1985-05-22 EP disclosed
US-4511577-A 2-/2-THIENOLYOXY/BENZOIC ACID MEDIA RESEARCH S.R.L. (IT) 1985-04-16 US disclosed
EP-0123094-A1 A novel derivative of benzoic acid MEDEA RESEARCH S.r.l. (IT) 1984-10-31 EP disclosed
EP-0064027-A1 Benzodioxole derivatives, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1982-11-03 EP disclosed
US-RE30812-E ANTIARRHTHMIA AGENTS MEAD JOHNSON & COMPANY (US) 1981-12-01 US disclosed
US-RE30811-E SEROTONIN ANTAGONISTS, ANTIARRHYTHMIA AGENTS MEAD JOHNSON & COMPANY (US) 1981-12-01 US disclosed
US-4064254-A ANTIARRHYTHMIC AND ANTISEROTONINE AGENTS MEAD JOHNSON & COMPANY (US) 1977-12-20 US disclosed