SCHEMBL20530244

SCHEMBL20530244

C/C(C(=O)O)=C(/C(=O)O)C1(C)CCCC1C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.32
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL2277283 0.77 FFAR3 (0.39) CYP1A2
SCHEMBL2277288 0.77 FFAR3 (0.39) CYP1A2
SCHEMBL2277287 0.77 FFAR3 (0.39) CYP1A2
SCHEMBL15913221 0.71 CNR1 (0.31) ALDH1A1TDP1
SCHEMBL3384400 0.71 FFAR3 (0.37)
SCHEMBL17191519 0.71 FFAR3 (0.37)
SCHEMBL7374383 0.71 PDK1 (0.35) CYP1A2ALDH1A1TDP1
SCHEMBL11518961 0.71 ALDH1A1 (0.41) ALDH1A1TDP1
SCHEMBL2015443 0.71 FFAR3 (0.37)
SCHEMBL20530256 0.70 CYP1A2 (0.31) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110494056-B Curable composition comprising HXNBR latex and multifunctional epoxide 阿朗新科德国有限责任公司 2021-11-12 CN disclosed
CN-113166280-A Method for producing PEG acrylate-HNBR copolymer 阿朗新科德国有限责任公司 2021-07-23 CN disclosed
EP-3387931-B1 VULCANIZABLE COMPOSITION COMPRISING HXNBR LATEX AND POLYFUNCTIONAL EPOXIDE ARLANXEO DEUTSCHLAND GMBH (DE) 2020-07-15 EP disclosed
CN-110770951-A Cathode of all-solid-state lithium ion battery and all-solid-state lithium ion battery comprising same 阿朗新科德国有限责任公司 2020-02-07 CN disclosed
WO-2018188966-A1 VULCANIZABLE COMPOSITION CONTAINING HXNBR LATEX AND POLYFUNCTIONAL EPOXIDE ARLANXEO DEUTSCHLAND GMBH (DE) 2018-10-18 WO disclosed
EP-3387931-A1 VULCANIZABLE COMPOSITION COMPRISING HXNBR LATEX AND POLYFUNCTIONAL EPOXIDE ARLANXEO Deutschland GmbH (DE) 2018-10-17 EP disclosed