SCHEMBL3858544

SCHEMBL3858544

O=C(CCC(=O)OC(C1CCCCCCCCCCC1)C1CCCCCCCCCCC1)OC(C1CCCCCCCCCCC1)C1CCCCCCCCCCC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 3/20 0.37
EPHX2 P34913 2/20 0.36
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GMNN O75496 1/20 0.34
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NAAA Q02083 1/20 0.34

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
SCHEMBL3858547 0.92 LMNA (0.51) EPHX1LMNAALDH1A1EPHX2SMN1; SMN2
SCHEMBL6536625 0.84 EPHX1 (0.45) EPHX1LMNAALDH1A1EPHX2GAA
SCHEMBL15219463 0.83 SHBG (0.40) EPHX1ALDH1A1EPHX2KDM4ENAAA
SCHEMBL5988036 0.83 EPHX1 (0.38) EPHX1LMNAALDH1A1EPHX2TP53
SCHEMBL20943419 0.79 EPHX1 (0.44) EPHX1ALDH1A1EPHX2TP53KDM4E
SCHEMBL27437211 0.79 NPSR1 (0.36) EPHX1LMNAALDH1A1EPHX2
SCHEMBL27436820 0.77 EPHX1 (0.40) EPHX1LMNAALDH1A1EPHX2KDM4E
SCHEMBL28400955 0.77 EPHX1 (0.43) EPHX1ALDH1A1EPHX2TP53KDM4E
SCHEMBL8461800 0.76 LMNA (0.39) LMNAALDH1A1EPHX2MAPTSMN1; SMN2
SCHEMBL6354274 0.76 NAAA (0.36) LMNAALDH1A1SMN1; SMN2NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585570-B2 A curable adhesive comprising acrylic ester polymers, a polysilsesquioxane or polysilicate, and a disisocyanate crosslinking agent; liquid crystal displays; glass substrates; films; durability; antipeeling agents; haze-free, nonblistering; antifoam agents; resistant to repeated cycles of heating/cooling SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-08 US disclosed
US-20080085417-A1 Comprises an acryl resin (butyl acrylate), an ionic compound containing a pyridinium based cation, and a crosslinker (tolylene diisocyanate) ; enhanced antistatic property and durability SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-04-10 US disclosed
US-20060252863-A1 A curable adhesive comprising acrylic ester polymers, a polysilsesquioxane or polysilicate, and a disisocyanate crosslinking agent; liquid crystal displays; glass substrates; films; durability; antipeeling agents; haze-free, nonblistering; antifoam agents; resistant to repeated cycles of heating/cooling SUMITOMO CHEMICHAL COMPANY, LIMITED 2006-11-09 US disclosed