SCHEMBL5656458

SCHEMBL5656458

C/C(=C\I)C(=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
SCHEMBL2258251 1.00
SCHEMBL3899168 1.00
SCHEMBL2808868 0.79
SCHEMBL2808870 0.79
SCHEMBL14952925 0.76 PTGS1 (0.39)
SCHEMBL14952926 0.76 PTGS1 (0.39)
SCHEMBL1396002 0.74 FFAR3 (0.43)
SCHEMBL18814 0.74
SCHEMBL1900173 0.74 PTGS1 (0.55)
SCHEMBL3791596 0.74 PTGS1 (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12623988-B2 Scaleable preparation of polyketides THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2026-05-12 US disclosed
US-20250288549-A1 SYNTHETIC PROCESS FOR PRODUCTION OF LIPOXIN B4 AND ANALOGUES THEREOF UNIVERSITY HEALTH NETWORK (CA) 2025-09-18 US disclosed
WO-2023205908-A1 SYNTHETIC PROCESS FOR PRODUCTION OF LIPOXIN B4 AND ANALOGUES THEREOF UNIVERSITY HEALTH NETWORK (CA) 2023-11-02 WO disclosed
US-20230029301-A1 SCALEABLE PREPARATION OF POLYKETIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-01-26 US disclosed
CN-114302721-A Scalable preparation of polyketones 加利福尼亚大学董事会 2022-04-08 CN disclosed
EP-2780336-B1 STRUCTURAL VARIANTS OF MYCOLACTONES FOR USE IN MODULATING INFLAMMATION, IMMUNITY AND PAIN PASTEUR INSTITUT (FR) 2017-07-19 EP disclosed
EP-2780336-B1 STRUCTURAL VARIANTS OF MYCOLACTONES FOR USE IN MODULATING INFLAMMATION, IMMUNITY AND PAIN PASTEUR INSTITUT (FR) 2017-07-19 EP disclosed
US-9598393-B2 Structural variants of mycolactones for use in modulating inflammation, immunity and pain INSTITUT PASTEUR (FR) 2017-03-21 US disclosed
EP-3012257-A1 Leiodermatolide derivatives and their use Studiengesellschaft Kohle mbH (DE) 2016-04-27 EP disclosed
US-20140329771-A1 STRUCTURAL VARIANTS OF MYCOLACTONES FOR USE IN MODULATING INFLAMMATION, IMMUNITY AND PAIN INSTITUT PASTEUR (FR) 2014-11-06 US disclosed
WO-2006017761-A2 EPOTHILONE ANALOGUES AS THERAPEUTIC AGENTS EMORY UNIVERSITY (US) 2006-02-16 WO disclosed
US-20040122037-A1 Isoxazoline derivatives as anti-depressants JANSSEN-CILAG S.A. (ES) 2004-06-24 US disclosed
CN-1492871-A Isoxazoline derivatives as anti-depressants ղɭҩҵ���޹�˾ 2004-04-28 CN disclosed
EP-1368358-A1 ISOXAZOLINE DERIVATIVES AS ANTI-DEPRESSANTS JANSSEN PHARMACEUTICA N.V. (BE) 2003-12-10 EP disclosed
WO-2002066484-A1 ISOXAZOLINE DERIVATIVES AS ANTI-DEPRESSANTS JANSSEN PHARMACEUTICA N.V. (BE) 2002-08-29 WO disclosed
EP-0642345-B1 Halichondrins and related compounds HARVARD COLLEGE (US) 2000-09-06 EP disclosed
US-5436238-A Halichondrins and related compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1995-07-25 US disclosed
EP-0642345-A4 HALICHONDRINS AND RELATED COMPOUNDS. HARVARD COLLEGE (US) 1995-04-19 EP disclosed
EP-0642345-A1 HALICHONDRINS AND RELATED COMPOUNDS THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1995-03-15 EP disclosed
WO-1993017690-A1 HALICHONDRINS AND RELATED COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1993-09-16 WO disclosed