SCHEMBL65345

SCHEMBL65345

C=C(C)COC(C)Oc1cccc(OC(C)OCC(=C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 11/20 0.41
MTNR1B P49286 11/20 0.41
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.35
NSD2 O96028 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GPR174 Q9BXC1 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL9181136 0.88 MTNR1A (0.42) MTNR1AMTNR1BLMNAKDM4EALDH1A1
SCHEMBL10870364 0.85 POLB (0.38) MTNR1AMTNR1BALDH1A1GPR174CYP2D6
SCHEMBL2153398 0.79 MAPT (0.37) LMNAALDH1A1GPR174MAPTCHRNB2
SCHEMBL10764863 0.79 ALDH1A1 (0.38) MTNR1AMTNR1BLMNAKDM4EALDH1A1
SCHEMBL2248368 0.78 POLB (0.40) LMNAALDH1A1CYP2D6MAPTCYP2C19
SCHEMBL548111 0.78 RAB9A (0.37) KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL6551445 0.78 KMT2A (0.56)
SCHEMBL3107707 0.77 SMN1; SMN2 (0.40) LMNASMN1; SMN2GPR174
SCHEMBL20885297 0.76 LMNA (0.44) MTNR1AMTNR1BLMNAKDM4ENSD2
SCHEMBL59812 0.76 HTT (0.36) KDM4EALDH1A1SMN1; SMN2CYP3A4MAPT

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0115709-B1 READILY CURABLE COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-03-01 EP claimed
JP-59126417-A None JP disclosed
US-8297975-B2 Reaction-curable adhesive composition and dental adhesive kit SUN MEDICAL CO., LTD. (JP) 2012-10-30 US disclosed
US-8129443-B2 Inorganic oxide nanoparticles having an X-ray contrast property and high transparency, a functionalized silanediol monomeric or oligomeric surface modifier, and a polymerizable compound; dental composites SUN MEDICAL CO., LTD. (JP) 2012-03-06 US disclosed
US-20100292359-A1 Reaction-Curable Adhesive Composition and Dental Adhesive Kit SUN MEDICAL CO., LTD. (JP) 2010-11-18 US disclosed
EP-2156817-A1 REACTION-SETTING ADHESIVE COMPOSITION, AND ADHESIVE MATERIAL KIT FOR DENTAL APPLICATIONS SUN MEDICAL CO., LTD. (JP) 2010-02-24 EP disclosed
US-20050123762-A1 Polymerizable composition, cured object obtained therefrom, and composite material SUN MEDICAL CO., LTD. (JP) 2005-06-09 US disclosed
EP-0266220-B1 CURABLE COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-01-07 EP disclosed
EP-0282280-B1 CURABLE ADHESIVE COMPOSITIONS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-05-20 EP disclosed
EP-0323521-B1 CURABLE COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-03-18 EP disclosed
US-4985516-A MONOACRYLATE, POLYACRYLATE, ACID ACRYLATE MONOMER, TRIALKYLBORON OR ITS OXIDE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-01-15 US disclosed
US-4966766-A ADMINISTERING TO A TOOTH OR GUM A MIXTURE OF AN ACRYLATE MONOMER, A POLYMERIZATION CATALYST AND A BACTERICIDE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-10-30 US disclosed
US-4925660-A ACRYLATE MONOMER, POLYMERIZATION INITIATOR, BACTERICIDE; PHOTOPOLYMERIZATION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-05-15 US disclosed
US-4920188-A (Meth)acrylate monomer; dental bonding agent MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-04-24 US disclosed
US-4830616-A GLUTARALDEHYDE, FERRIC CHLORIDE, EDTA, ACRYLIC ESTER POLYMER, BONDING STRENGTH Okuda, Reiichi (JP) 1989-05-16 US disclosed
US-4826893-A POLYSILSESQUIOXANE-ACRYLIC ESTER COPOLYMER G-C DENTAL INDUSTRIAL CORP. (JP) 1989-05-02 US disclosed
US-4758643-A Dental adhesive resin compositions G-C DENTAL INDUSTRIAL CORP. (JP) 1988-07-19 US disclosed
EP-0266220-A2 Curable composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-05-04 EP disclosed
EP-0223245-A2 Curable compositions for dental drugs having sustained release property MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1987-05-27 EP disclosed
JP-S59126417-A INSTANTANEOUS CURING COMPOSITION MITSUI PETROCHEM IND LTD 1984-07-21 JP disclosed