SCHEMBL8767243

SCHEMBL8767243

C=C(Cc1ccccc1)C(=O)OO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.50
CES2 O00748 1/20 0.50
AKR1B1 P15121 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
PAM P19021 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
TSHR P16473 2/20 0.43
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
CTBP2 P56545 1/20 0.41
EPHX2 P34913 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 2/20 0.39
ABCC4 O15439 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL28582716 0.86 CES1 (0.52) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL28321505 0.84 L3MBTL1 (0.41) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL4623853 0.83 CES2 (0.45) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL28118587 0.82 CES2 (0.48) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL11488800 0.82 CES1 (0.48) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL4759853 0.82 CES1 (0.48) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL1666500 0.82 CES2 (0.48) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL27498965 0.82 CES1 (0.48) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL27918597 0.82 CES1 (0.48) CES1CES2AKR1B1L3MBTL1ALDH1A1
SCHEMBL10581202 0.82 CES1 (0.48) CES1CES2AKR1B1L3MBTL1ALDH1A1

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
CN-112745655-A Modified polyphenyl ether and polyethylene co-extrusion section bar and preparation method thereof 哈尔滨中大型材科技股份有限公司 2021-05-04 CN disclosed
CN-104928555-A Multi-effect composite material for automotive impact beams QINGDAO JINGSHITONG PREC MACHINERY MFG CO LTD 2015-09-23 CN disclosed
EP-0781200-A1 OXYGEN SCAVENGING STRUCTURES HAVING ORGANIC OXYGEN SCAVENGING MATERIAL AND HAVING A POLYMERIC SELECTIVE BARRIER CHEVRON CHEMICAL COMPANY (US) 1997-07-02 EP disclosed
WO-1996008371-A1 OXYGEN SCAVENGING STRUCTURES HAVING ORGANIC OXYGEN SCAVENGING MATERIAL AND HAVING A POLYMERIC SELECTIVE BARRIER CHEVRON CHEMICAL COMPANY (US) 1996-03-21 WO disclosed