SCHEMBL12723966

SCHEMBL12723966

C=CC(=O)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
SCHEMBL15477716 1.00
SCHEMBL7541813 0.85 TSHR (0.42)
SCHEMBL7541809 0.85 TSHR (0.42)
SCHEMBL29133173 0.82 TSHR (0.38)
SCHEMBL27889350 0.78 TSHR (0.37)
SCHEMBL34966 0.76
SCHEMBL30510595 0.76
SCHEMBL195214 0.76
SCHEMBL28763154 0.76
SCHEMBL30817329 0.76 TSHR (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170114193-A1 Polyolefin Pipe UPONOR INNOVATION AB (SE) 2017-04-27 US disclosed
US-20160130420-A1 Polyolefin Pipe UPONOR INNOVATION AB (SE) 2016-05-12 US disclosed
US-20140049728-A1 LIGHT GUIDE PLATE, LIGHT-EMITTING UNIT AND LIQUID CRYSTAL DISPLAY DEVICE HAVING THE SAME CHI MEI CORPORATION (TW) 2014-02-20 US disclosed
US-7932301-B2 Encapsulant composition and method for fabricating encapsulant material INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2011-04-26 US disclosed