SCHEMBL868459

SCHEMBL868459

C/C=C(/CC)CC(=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
SCHEMBL10779589 1.00
SCHEMBL868460 1.00
Malonic Acid SCHEMBL28931093 0.89 LDHA (0.50)
Bicarbonate SCHEMBL4362323 0.79 FFAR3 (0.47)
SCHEMBL6026397 0.79 FFAR3 (0.43)
SCHEMBL10947855 0.79 HDAC3 (0.50)
SCHEMBL10947852 0.79 HDAC3 (0.50)
SCHEMBL8539187 0.79 FFAR3 (0.43)
SCHEMBL6725289 0.78
SCHEMBL6725287 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2414456-B1 DEGRADABLE POLYMER COMPOSITIONS AND USES THEREOF ISP INVESTMENTS LLC (US) 2018-12-26 EP claimed
US-8895478-B2 Degradable polymer compositions and uses thereof ISP INVESTMENTS INC. (US) 2014-11-25 US claimed
US-20120157352-A1 DEGRADABLE POLYMER COMPOSITIONS AND USES THEREOF ISP INVESTMENTS INC. (US) 2012-06-21 US claimed
US-20120077717-A1 Polymers Having N-Vinyl Amide And Hydroxyl Moieties, Their Compositions And The Uses Thereof ISP INVESTMENTS INC. (US) 2012-03-29 US claimed
US-10400052-B2 Polymers having N-vinyl amide and hydroxyl moieties, their compositions and the uses thereof ISP INVESTMENTS LLC (US) 2019-09-03 US disclosed
US-8895478-B2 Degradable polymer compositions and uses thereof ISP INVESTMENTS INC. (US) 2014-11-25 US disclosed
US-20120157352-A1 DEGRADABLE POLYMER COMPOSITIONS AND USES THEREOF ISP INVESTMENTS INC. (US) 2012-06-21 US disclosed
US-20120077717-A1 Polymers Having N-Vinyl Amide And Hydroxyl Moieties, Their Compositions And The Uses Thereof ISP INVESTMENTS INC. (US) 2012-03-29 US disclosed