SCHEMBL3985694

SCHEMBL3985694

C=CC[C](O)C(=C)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
SCHEMBL3365860 0.78 TSHR (0.32)
SCHEMBL7155990 0.75
SCHEMBL7016552 0.73 TSHR (0.33)
SCHEMBL13176961 0.73
SCHEMBL1101331 0.72
SCHEMBL30048 0.71 ALOX15 (0.34)
SCHEMBL3856546 0.71
SCHEMBL9341851 0.69
SCHEMBL4243864 0.69
SCHEMBL2486474 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2009526053-A 2009-07-16 JP claimed
EP-1981837-A2 METHODS AND COMPOSITIONS FOR MODULATING SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR ACTIVITY Praecis Pharmaceuticals Incorporated (US) 2008-10-22 EP claimed
WO-2007092190-A2 METHODS AND COMPOSITIONS FOR MODULATING SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR ACTIVITY PRAECIS PHARMACEUTICALS, INC. (US) 2007-08-16 WO claimed
CN-1620433-A pyrrolidine derivatives as endothelin converting enzyme inhibitors HOFFMANN LA ROCHE (CH) 2005-05-25 CN claimed
EP-0897808-B1 Recording sheets and ink jet printing processes therewith XEROX CORP (US) 2004-06-16 EP claimed
EP-1303485-A1 PYRROLIDINE DERIVATIVES AS INHIBITORS OF ENDOTHELIN-CONVERTING ENZYME F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP claimed
US-20020049243-A1 Pyrrolidine derivatives HOFFMANN-LA ROCHE INC. 2002-04-25 US claimed
WO-2002006222-A1 PYRROLIDINE DERIVATIVES AS INHIBITORS OF ENDOTHELIN-CONVERTING ENZYME F. HOFFMANN-LA ROCHE AG (CH) 2002-01-24 WO claimed
US-6258873-B1 Ink compositions substantially free of organic liquids XEROX CORPORATION 2001-07-10 US claimed
US-6117527-A RECORDING SHEET COMPRISING SUBSTRATE HAVING IMAGE-RECEIVING COATING ON SURFACE COMPRISING BINDER POLYMER AND SELECTED ADDITIVE; HIGH QUALITY IMAGES WITH REDUCED OR NO HAZE XEROX CORPORATION (US) 2000-09-12 US claimed
EP-0897808-A1 Recording sheets and ink jet printing processes therewith Xerox Corporation (US) 1999-02-24 EP claimed
EP-0615858-A1 Transparent recording sheets XEROX CORPORATION (US) 1994-09-21 EP claimed
US-5330823-A Transparent recording sheets XEROX CORPORATION (US) 1994-07-19 US claimed
US-20180194128-A1 ENHANCED MASK FOR REDUCING LIGHT SCATTERING ULANO INTERNATIONAL 2018-07-12 US disclosed
WO-2017144393-A1 2-SUBSTITUTED 5-(PHENYL)-1,2-DIHYDRO-3H-3-BENZAZEPINE-3-CARBOXAMIDE DERIVATIVES AS BRD4 INHIBITORS FOR THE TREATMENT OF CANCER BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-08-31 WO disclosed
US-20090208675-A1 INKJET RECORDING MEDIA FOR RECORDING SPARKLING METALLIC OR SEMI-METALLIC IMAGES WITH AN INK RECEPTIVE SURFACE FOR RECORDING OF A NEGATIVE OR POSITIVE IMAGE AND AN ADHESIVE TOP OR BOTTOM LAYER THAT MAY BE OPTIONALLY RENDERED OPAQUE AND AN OPTIONALLY REMOVABLE PROTECTIVE LAYER WHEREIN THE ADHESIVE LAYER SURFACE CAN BE APPLIED TO TEXTILE ARTICLES OF COMMERCE NIGAM ASUTOSH 2009-08-20 US disclosed
US-5314747-A Recording sheets containing cationic sulfur compounds XEROX CORPORATION (US) 1994-05-24 US disclosed
US-5302439-A Electrography, offset printing; substrate with binder, additives, antistatic agents XEROX CORPORATION (US) 1994-04-12 US disclosed
EP-0566269-A1 Coated recording sheets for water resistant images XEROX CORPORATION (US) 1993-10-20 EP disclosed
US-5223338-A Coated recording sheets for water resistant images XEROX CORPORATION (US) 1993-06-29 US disclosed