SCHEMBL844108

SCHEMBL844108

COC(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
SCHEMBL15313305 0.76 TSHR (0.33)
SCHEMBL4641855 0.75
SCHEMBL1299349 0.73
SCHEMBL14513530 0.71 ALDH1A1 (0.32)
SCHEMBL29164372 0.71
SCHEMBL10431804 0.71
SCHEMBL5976304 0.71 CA4 (0.33)
SCHEMBL5976308 0.71
SCHEMBL6570958 0.71
SCHEMBL258962 0.71

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608711-B1 INK FOR A POLYCARBONATE SUBSTRATE EXATEC LLC (US) 2006-12-27 EP claimed
EP-1608711-A1 INK FOR A POLYCARBONATE SUBSTRATE Exatec, LLC. (US) 2005-12-28 EP claimed
US-6958189-B2 Ink for a polycarbonate substrate EXATEC, LLC (US) 2005-10-25 US claimed
WO-2004092288-A1 INK FOR A POLYCARBONATE SUBSTRATE EXATEC, L.L.C. (US) 2004-10-28 WO claimed
US-20040191521-A1 Ink for a polycarbonate substrate EXATEC LLC 2004-09-30 US claimed
US-11264576-B2 Specifically substituted ladder type compounds for organic light emitting devices IDEMITSU KOSAN CO., LTD. (JP) 2022-03-01 US disclosed
WO-2018116152-A1 SPECIFICALLY SUBSTITUTED LADDER TYPE COMPOUNDS FOR ORGANIC LIGHT EMITTING DEVICES IDEMITSU KOSAN CO., LTD. (JP) 2018-06-28 WO disclosed
EP-2184270-B1 Zeolite-catalyzed preparation of alpha-hydroxy carboxylic acid compounds and esters thereof HALDOR TOPSOE AS (DK) 2013-02-13 EP disclosed
US-8143439-B2 Zeolite-catalyzed preparation of alpha-hydroxy carboxylic acids and esters thereof HALDOR TOPSØE A/S (DK) 2012-03-27 US disclosed
US-8143439-B2 Zeolite-catalyzed preparation of alpha-hydroxy carboxylic acids and esters thereof HALDOR TOPSØE A/S (DK) 2012-03-27 US disclosed
US-20110196038-A1 Bipolar trans carotenoid salts and their uses DIFFUSION PHARMACEUTICALS LLC (US) 2011-08-11 US disclosed
US-20100121096-A1 ZEOLITE-CATALYZED PREPARATION OF ALPHA-HYDROXY CARBOXYLIC ACIDS AND ESTERS THEREOF TOPSOE A/S (DK) 2010-05-13 US disclosed
US-20100121096-A1 ZEOLITE-CATALYZED PREPARATION OF ALPHA-HYDROXY CARBOXYLIC ACIDS AND ESTERS THEREOF TOPSOE A/S (DK) 2010-05-13 US disclosed