Sugi Predict

Sugi Predict / Compounds / SCHEMBL28107682

SCHEMBL28107682

SCHEMBL28107682

CCC(CC)(CC(=O)OC)C(=O)OC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 2/20 0.46
▸ NAAA Q02083 2/20 0.43
▸ EPHX2 P34913 4/20 0.40
▸ HTT P42858 3/20 0.39
▸ CYP19A1 P11511 3/20 0.38
▸ CYP2C19 P33261 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL28784765 0.90 NAAA (0.49) EPHX1NAAAEPHX2HTTCYP19A1
SCHEMBL28107686 0.89 NAAA (0.47) EPHX1NAAAEPHX2HTTCYP19A1
SCHEMBL19690609 0.88 NAAA (0.46) EPHX1NAAAEPHX2HTTCYP19A1
SCHEMBL19690607 0.84 EPHX1 (0.45) EPHX1NAAAHTTCYP19A1CYP2C19
SCHEMBL27013612 0.78 EPHX2 (0.43) EPHX1NAAAEPHX2HTTCYP19A1
SCHEMBL28004225 0.77 EPHX1 (0.51) EPHX1NAAAEPHX2HTTCYP19A1
SCHEMBL19548407 0.75 TSHR (0.40) ALDH1A1TSHRHSD17B10
SCHEMBL13278561 0.75 CHRM3 (0.37) EPHX1NAAACYP19A1CYP2C19TSHR
SCHEMBL21136583 0.74 EPHX1 (0.39) EPHX1NAAAEPHX2HTTCYP19A1
SCHEMBL8980126 0.73 NAAA (0.47) EPHX1NAAAEPHX2HTTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109923170-A Concentrate composition and polypropylene resin composite comprising the concentrate composition 胜亚诺盟股份有限公司 2019-06-21 — — CN disclosed
CN-108570119-A A kind of ingredient of solid catalyst containing naphthylenediamine class compound, catalyst and its application 北京利和知信科技有限公司 2018-09-25 — — CN disclosed
CN-108570120-A Ingredient of solid catalyst and catalyst containing o-phenylenediamine class compound and its application 北京利和知信科技有限公司 2018-09-25 — — CN disclosed
CN-108517022-A For the ingredient of solid catalyst and its catalyst of olefinic polymerization and application 北京利和知信科技有限公司 2018-09-11 — — CN disclosed
CN-108219295-A Polypropene composition, polypropylene film-making material and its manufacturing method and secondary forming body 富比食品包装有限公司 2018-06-29 — — CN disclosed
CN-108117617-A A kind of ingredient of solid catalyst and catalyst for olefinic polymerization 任丘市利和科技发展有限公司 2018-06-05 — — CN disclosed
CN-104736627-B Boiling film propylene resin composition 胜亚诺盟股份有限公司 2018-04-17 — — CN disclosed
CN-103923238-B Catalytic component and catalyst for olefinic polymerization 北京利和知信科技有限公司 2018-03-02 — — CN disclosed
CN-104045748-B Ingredient of solid catalyst and catalyst for olefinic polymerization 北京利和知信科技有限公司 2017-12-26 — — CN disclosed
CN-107417819-A A kind of ingredient of solid catalyst, catalyst and its application for olefinic polymerization 北京利和知信科技有限公司 2017-12-01 — — CN disclosed
CN-107417818-A It is a kind of for the catalytic component of olefinic polymerization, preparation method and catalyst 北京利和知信科技有限公司 2017-12-01 — — CN disclosed
CN-104109212-B Solid catalyst component for olefine polymerization and catalyst 北京利和知信科技有限公司 2017-11-07 — — CN disclosed
CN-104479055-B A kind of dialkoxy-magnesium support type ingredient of solid catalyst and catalyst 任丘市利和科技发展有限公司 2017-06-06 — — CN disclosed
CN-103476806-B Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限责任公司 2016-12-07 — — CN disclosed