SCHEMBL7942472

SCHEMBL7942472

CC(=O)Oc1ccccc1OOC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.50
HSD17B10 Q99714 3/20 0.50
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
TSHR P16473 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
ESR1 P03372 1/20 0.50
ITGB3 P05106 1/20 0.50
ITGA2B P08514 1/20 0.50
HMGB1 P09429 1/20 0.50
HPGD P15428 1/20 0.50
GGT1 P19440 1/20 0.50
PTGS1 P23219 1/20 0.50
BLM P54132 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
MAPK1 P28482 1/20 0.42
ACHE P22303 1/20 0.41

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
SCHEMBL10420584 0.87 ALDH1A1 (0.43) PTGS2HSD17B10KDM4EALDH1A1TSHR
SCHEMBL10420585 0.85 HSD17B10 (0.46) PTGS2HSD17B10KDM4EALDH1A1TSHR
SCHEMBL29432883 0.82 PTGS2 (0.68) PTGS2HSD17B10KDM4EALDH1A1TSHR
SCHEMBL4116458 0.82 CA1 (0.41) HSD17B10KDM4EALDH1A1TSHRTDP1
SCHEMBL338196 0.82 PTGS2 (0.68) PTGS2HSD17B10KDM4EALDH1A1TSHR
Iodide SCHEMBL30619798 0.80 PTGS2 (0.65) PTGS2HSD17B10KDM4EALDH1A1TSHR
Ethylene SCHEMBL28225928 0.78 PTGS2 (0.63) PTGS2HSD17B10KDM4EALDH1A1TSHR
SCHEMBL15548450 0.77 ELANE (0.65) PTGS2HSD17B10KDM4EALDH1A1TSHR
SCHEMBL10496464 0.76 PTGS2 (0.61) PTGS2HSD17B10KDM4EALDH1A1TSHR
SCHEMBL31571285 0.76 ELANE (0.58) PTGS2HSD17B10KDM4EALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111836853-B Acrylonitrile-butadiene rubber composition and laminate comprising layer of the composition 三井化学株式会社 2022-06-28 CN disclosed
CN-110198963-B Process for producing low emission heterophasic polypropylene SABIC环球技术有限责任公司 2022-06-24 CN disclosed
CN-110248968-B Process for producing low emission homopolymer or atactic polypropylene SABIC环球技术有限责任公司 2022-05-27 CN disclosed
US-6271288-B1 POLYPROPYLENE, POLYETHYLENE AND CELLULOSE ESTERS AND ORGANIC PEROXIDE OKURA INDUSTRIAL CO., LTD. (JP) 2001-08-07 US disclosed
EP-0364956-B1 Laminate MITSUI PETROCHEMICAL IND (JP) 1994-08-10 EP disclosed
US-5106692-A High strength, adhesion MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-04-21 US disclosed
EP-0364956-A1 Laminate MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-04-25 EP disclosed