SCHEMBL5794937

SCHEMBL5794937

C=CCS([O])=O

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
SCHEMBL1139865 0.69
SCHEMBL9640525 0.67
SCHEMBL17501260 0.67
SCHEMBL7090604 0.63
SCHEMBL25453246 0.63
SCHEMBL2777129 0.61
SCHEMBL3054233 0.59
Allylamine SCHEMBL8027697 0.59
Sulfurous Acid SCHEMBL25287274 0.57
SCHEMBL175147 0.54

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233794-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF ADT Pharmaceuticals, Inc. (US) 2017-10-25 EP claimed
WO-2016100542-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF ADT PHARMACEUTICALS, INC. (US) 2016-06-23 WO claimed
EP-1509530-B1 2-THIA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF PLIVA ISTRAZIVACKI INST D O O (HR) 2006-03-15 EP claimed
US-20050182126-A1 2-Thia-dibenzoazulenes as inhibitors of tumour necrosis factor production and intermediates for the preparation thereof PILVA-ISTRAZIVACKI INSTITUT D.O.O. 2005-08-18 US claimed
US-20050131056-A1 2- thia-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the preparation thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2005-06-16 US claimed
US-4559346-A Certain N-octahydro-indolizinebenzamides and their use in treating psychosis, cardiac arrhythmia and hypertension BEECHAM GROUP P.L.C. (GB) 1985-12-17 US claimed
US-20230406803-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS Kinesid Therapeutics, Inc (US) 2023-12-21 US disclosed
WO-2021153720-A1 3-ALKOXY BENZOIC ACID AMIDE DERIVATIVE, AND PEST CONTROL AGENT クミアイ化学工業株式会社 2021-08-05 WO disclosed
US-20180265519-A1 TRICYCLIC PROTEASOME ACTIVITY ENHANCING COMPOUNDS THE ASSAY DEPOT, INC. 2018-09-20 US disclosed
EP-3233794-A1 INDENYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND MEDICAL USES THEREOF ADT Pharmaceuticals, Inc. (US) 2017-10-25 EP disclosed
EP-3233071-A1 METHOD OF TREATING OR PREVENTING RAS-MEDIATED DISEASES ADT Pharmaceuticals, Inc. (US) 2017-10-25 EP disclosed
EP-3233070-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT Pharmaceuticals, Inc. (US) 2017-10-25 EP disclosed
WO-2016099452-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, INC. (US) 2016-06-23 WO disclosed
US-4052413-A STEREOSPECIFIC TOTAL STEROIDAL SYNTHESIS VIA SUBSTITUTED C/D-TRANS INDANONES HOFFMANN-LA ROCHE, INC. (US) 1977-10-04 US disclosed
US-4049677-A Stereospecific total steroidal synthesis via substituted C/D-trans indanones HOFFMAN-LA ROCHE INC. (US) 1977-09-20 US disclosed
US-4048195-A Process of synthesizing substituted indanones HOFFMANN-LA ROCHE INC. (US) 1977-09-13 US disclosed
US-3985733-A Stereospecific total steroidal synthesis via substituted C/D-trans indanones HOFFMANN-LA ROCHE INC. (US) 1976-10-12 US disclosed
US-3984473-A Stereospecific total steroidal synthesis via substituted C/D-trans indanones HOFFMANN-LA ROCHE INC. (US) 1976-10-05 US disclosed
US-3965117-A Stereospecific total steroidal synthesis via substituted c/d-trans indanones HOFFMANN-LA ROCHE INC. (US) 1976-06-22 US disclosed
US-3950389-A Stereospecific total steroidal synthesis via substituted C/D-trans indanones HOFFMANN-LA ROCHE INC. (US) 1976-04-13 US disclosed