SCHEMBL2580975

SCHEMBL2580975

[CH2]C(OC(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
SCHEMBL9320742 0.80
SCHEMBL6447990 0.76 ALDH1A1 (0.43)
SCHEMBL5074472 0.75
SCHEMBL1314477 0.75 TSHR (0.53)
SCHEMBL4740246 0.73
SCHEMBL1218122 0.73
SCHEMBL50977 0.73
SCHEMBL8682614 0.73
SCHEMBL7253833 0.73
SCHEMBL6561830 0.71 TSHR (0.56)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0810246-B1 Method of producing isocyanate-modified latex polymer ROHM & HAAS (US) 2004-07-28 EP claimed
US-6153690-A REACTING A DI- OR POLYISOCYANATE WITH AN ISOCYANATE-REACTIVE POLYMER TO PRODUCE THE ISOCYANATE-MODIFIED ACRYLIC POLYMER OF THE PRESENT INVENTION HAVING EXTENDED SHELF STABILITY AND SOLVENT RESISTANCE. ROHM AND HAAS COMPANY (US) 2000-11-28 US claimed
EP-0810246-A2 Method of producing isocyanate-modified latex polymer ROHM AND HAAS COMPANY (US) 1997-12-03 EP claimed
EP-4394003-A1 COATING MATERIAL FOR IMPARTING MINERAL OIL RESISTANCE AND MULTILAYER BODY Mitsui Chemicals, Inc. (JP) 2024-07-03 EP disclosed
US-20230416658-A1 COMPOSITIONS COMPRISING PROTONATED TRIAZACYCLIC COMPOUNDS AND MANGANESE(II) ACETATE, MANUFACTURING THEREOF, AND BLEACHING AND CLEANING AGENT COMPRISING SAME CATEXEL GMBH (DE) 2023-12-28 US disclosed
EP-4296344-A1 COMPOSITIONS COMPRISING PROTONATED TRIAZACYCLIC COMPOUNDS AND MANGANESE(II) ACETATE, MANUFACTURING THEREOF, AND BLEACHING AND CLEANING AGENT COMPRISING SAME WeylChem Performance Products GmbH (DE) 2023-12-27 EP disclosed
EP-4251665-A1 PROCESS OF PRODUCING POLYMER DISPERSIONS BASF SE (DE) 2023-10-04 EP disclosed
WO-2022112190-A1 PROCESS OF PRODUCING POLYMER DISPERSIONS BASF SE (DE) 2022-06-02 WO disclosed
US-20190249120-A1 CATALYST COMPOSITION Itaconix, Zone 2 (U.K.) Limited (GB) 2019-08-15 US disclosed
EP-3484989-A1 CATALYST COMPOSITION Itaconix (U.K.) Limited (GB) 2019-05-22 EP disclosed
EP-3390473-A1 AQUEOUS POLYMER DISPERSIONS OF LOW EMULSIFIER CONTENT FOR PRODUCING COMPOSITE FILMS BASF SE (DE) 2018-10-24 EP disclosed
EP-0810246-B1 Method of producing isocyanate-modified latex polymer ROHM & HAAS (US) 2004-07-28 EP disclosed
US-20040047694-A1 Polymer-modified earth building materials BASF AKTIENGESELLSCHAFT (DE) 2004-03-11 US disclosed
US-6153690-A REACTING A DI- OR POLYISOCYANATE WITH AN ISOCYANATE-REACTIVE POLYMER TO PRODUCE THE ISOCYANATE-MODIFIED ACRYLIC POLYMER OF THE PRESENT INVENTION HAVING EXTENDED SHELF STABILITY AND SOLVENT RESISTANCE. ROHM AND HAAS COMPANY (US) 2000-11-28 US disclosed
US-5948833-A BLEND OF BINDER AND CHELATE COMPOUND ROHM AND HAAS COMPANY (US) 1999-09-07 US disclosed
EP-0810246-A2 Method of producing isocyanate-modified latex polymer ROHM AND HAAS COMPANY (US) 1997-12-03 EP disclosed
EP-0372804-A2 Ambient temperature curing polymer compositions RHONE-POULENC CHEMICALS LIMITED (GB) 1990-06-13 EP disclosed
EP-0334643-A1 Fluorocarbon polymer compositions and methods HOECHST CELANESE CORPORATION (US) 1989-09-27 EP disclosed
EP-0007142-B1 NOVEL INTERMEDIATES IN THE PREPARATION OF CYCLOPROPANECARBOXYLATE ESTERS AND PROCESS FOR THEIR MANUFACTURE SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1982-05-12 EP disclosed
EP-0007142-A1 Novel intermediates in the preparation of cyclopropanecarboxylate esters and process for their manufacture SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1980-01-23 EP disclosed