SCHEMBL28656719

SCHEMBL28656719

C=CCc1ccc(-c2cccc(OC)c2)c(CC=C)c1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAT2 Q10469 1/20 0.43
▸ CYP3A4 P08684 3/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ CYP1A1 P04798 1/20 0.40
▸ CYP2E1 P05181 1/20 0.40
▸ CYP2C8 P10632 1/20 0.40
▸ CYP2A6 P11509 1/20 0.40
▸ CYP4B1 P13584 1/20 0.40
▸ CYP2B6 P20813 1/20 0.40
▸ CYP3A5 P20815 1/20 0.40
▸ CYP2A7 P20853 1/20 0.40
▸ CYP3A7 P24462 1/20 0.40
▸ CYP2F1 P24903 1/20 0.40
▸ CYP2C18 P33260 1/20 0.40
▸ CYP2J2 P51589 1/20 0.40
▸ CYP4F2 P78329 1/20 0.40
▸ CYP4F8 P98187 1/20 0.40

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
SCHEMBL4979339 0.79 HTR7 (0.48) MGAT2CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL8522778 0.74 GSTP1 (0.36) KDM4EGABRA1GABRB2CLK4ALDH1A1
SCHEMBL44672 0.71 GABRA1 (0.48) CYP3A4KDM4EMAPTALOX5GABRA1
SCHEMBL8522775 0.70 KDM4E (0.37) KDM4EMAPTGABRA1GABRB2CLK4
SCHEMBL8255326 0.70 DCTPP1 (0.44) KDM4EGFERNR3C1PGRTDO2
SCHEMBL28680076 0.70 CYP1A1 (0.44) MGAT2CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL28091292 0.69 ALDH1A1 (0.51) CYP3A4KDM4EMAPTALOX5GABRA1
SCHEMBL2096402 0.68 ALDH1A1 (0.57) CYP3A4MAPTPTPN1ALDH1A1LMNA
SCHEMBL2091147 0.67 ALDH1A1 (0.60) CYP3A4ALOX5ALDH1A1TSHRTP53
SCHEMBL29382328 0.67 ALDH1A1 (0.60) CYP3A4ALOX5ALDH1A1TSHRTP53

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-113896694-B Polyfunctional group hybrid epoxy compound and photo-thermal dual-curing resin composition as well as preparation method and application thereof 韦尔通(厦门)科技股份有限公司 2022-12-06 — — CN disclosed
CN-113788935-B Epoxy resin composition and preparation method and application thereof 韦尔通(厦门)科技股份有限公司 2022-05-27 — — CN disclosed
CN-113788936-B Light/heat dual-curing resin composition and preparation method and application thereof 韦尔通(厦门)科技股份有限公司 2022-05-10 — — CN disclosed
CN-113943420-A UV (ultraviolet) light-cured resin composition and preparation method and application thereof 韦尔通(厦门)科技股份有限公司 2022-01-18 — — CN disclosed
CN-113896694-A Polyfunctional group hybrid epoxy compound and photo-thermal dual-curing resin composition as well as preparation method and application thereof 韦尔通(厦门)科技股份有限公司 2022-01-07 — — CN disclosed
CN-113788936-A Light/heat dual-curing resin composition and preparation method and application thereof 韦尔通(厦门)科技股份有限公司 2021-12-14 — — CN disclosed
CN-113788935-A Epoxy resin composition and preparation method and application thereof 韦尔通(厦门)科技股份有限公司 2021-12-14 — — CN disclosed
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