SCHEMBL4502804

SCHEMBL4502804

O=C1C=C(O)CC1

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
SCHEMBL1374641 0.82
SCHEMBL14427919 0.80 ALDH1A1 (0.38)
SCHEMBL3214514 0.73
SCHEMBL9418654 0.71
SCHEMBL9418657 0.71
Ammonia Solution, Strong SCHEMBL9418650 0.71
SCHEMBL7194986 0.71
SCHEMBL29276731 0.66 ESR2 (0.39)
SCHEMBL9368368 0.65
SCHEMBL691808 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210115087-A1 CYCLIC PEPTIDE INHIBITORS OF HEDGEHOG PROTEINS UNIV ROCHESTER (US) 2021-04-22 US claimed
US-20190241615-A1 CYCLIC PEPTIDE INHIBITORS OF HEDGEHOG PROTEINS UNIVERSITY OF ROCHESTER 2019-08-08 US claimed
EP-3475294-A1 CYCLIC PEPTIDE INHIBITORS OF HEDGEHOG PROTEINS The University of Rochester (US) 2019-05-01 EP claimed
WO-2017223207-A1 CYCLIC PEPTIDE INHIBITORS OF HEDGEHOG PROTEINS UNIVERSITY OF ROCHESTER (US) 2017-12-28 WO claimed
EP-0440251-B1 Process for preparing optically active cyclopentenones SUMITOMO CHEMICAL CO (JP) 1995-09-06 EP claimed
US-5191109-A Process for preparing optically active cyclopentenones SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-02 US claimed
EP-0440251-A2 Process for preparing optically active cyclopentenones SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-08-07 EP claimed
EP-0213313-A2 Precursors and synthesis of methyl-9-oxo-11 alpha, 16-dihydroxy-16-vinyl-5-cis-13-trans prostadienoates AMERICAN CYANAMID COMPANY (US) 1987-03-11 EP claimed
US-4304934-A Synthesis of amino hydroxy cyclopentenones POLAROID CORPORATION (US) 1981-12-08 US claimed
JP-4211398-A None JP disclosed
EP-4619401-A1 AHR AGONISTS Eli Lilly and Company (US) 2025-09-24 EP disclosed
US-12264169-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners (US) 2025-04-01 US disclosed
WO-2024107555-A1 AHR AGONISTS ELI LILLY AND COMPANY (US) 2024-05-23 WO disclosed
US-20230348501-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2023-11-02 US disclosed
US-4178456-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1979-12-11 US disclosed
US-4172839-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1979-10-30 US disclosed
US-4170597-A 1-Hydroxymethyl-1-oxo-prostane derivatives of the E2 series AMERICAN CYANAMID COMPANY (US) 1979-10-09 US disclosed
EP-0002590-A1 Novel prostaglandin compounds, processes for the preparation thereof and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1979-06-27 EP disclosed
US-4131737-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1978-12-26 US disclosed
US-4109662-A SMOKING FRITZSCHE DODGE & OLCOTT INC. (US) 1978-08-29 US disclosed