SCHEMBL88383

SCHEMBL88383

C=C(C(=O)OCC1CO1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
MGLL Q99685 6/20 0.48
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL4441961 0.79 ALDH1A1 (0.54) ALDH1A1MGLLTDP1
SCHEMBL7759577 0.77 MGLL (0.62) ALDH1A1MGLLTDP1
Biphenyl SCHEMBL28529224 0.77 ALDH1A1 (0.73) ALDH1A1MGLLTDP1
SCHEMBL4838795 0.77 ALDH1A1 (0.51) ALDH1A1MGLLTDP1
SCHEMBL6712607 0.75 MGLL (0.47) ALDH1A1MGLLTDP1
Toluene SCHEMBL8175017 0.75 ALDH1A1 (0.71) ALDH1A1MGLLTDP1
Phenol SCHEMBL727251 0.75 ALDH1A1 (0.71) ALDH1A1MGLLTDP1
Benzylamine SCHEMBL28872943 0.75 ALDH1A1 (0.66) ALDH1A1MGLLTDP1
O-Xylene SCHEMBL27077638 0.75 ALDH1A1 (0.76) ALDH1A1MGLL
SCHEMBL27511033 0.75 TDP1 (0.44) ALDH1A1MGLLTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109939006-A A kind of preparation method of light-cured composite 安庆市泽烨新材料技术推广服务有限公司 2019-06-28 CN claimed
CN-109820734-A A kind of light-cured composite 安庆市泽烨新材料技术推广服务有限公司 2019-05-31 CN claimed
CN-109233702-A A kind of parents' modified acrylic ester copolymer bonding agent and preparation method thereof 点铂医疗科技(常州)有限公司 2019-01-18 CN claimed
CN-106038322-B A kind of high-strength and high-modulus antibacterial gear division reparation compound resin and preparation method thereof 东华大学 2018-10-23 CN claimed
CN-108403445-A A kind of light-cured composite material 苏州新益特塑胶科技有限公司 2018-08-17 CN claimed
CN-107320340-A Nanocomposite crown and bridge material 点铂医疗科技(常州)有限公司 2017-11-07 CN claimed
US-20120202171-A1 DENTAL APPLIANCE D ANJOU LISSA T (US) 2012-08-09 US claimed
US-20120093741-A1 DENTAL MASKING COMPOUND VOCO GMBH (DE) 2012-04-19 US claimed
US-8129188-B2 Cell culture apparatus and method of fabricating the apparatus INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-03-06 US claimed
US-20110250558-A1 DUAL-CURING, MULTI-COMPONENT DENTAL COMPOSITION VOCO GMBH (DE) 2011-10-13 US claimed
WO-2011106089-A1 BENZALKONIUM CHLORIDE COMPOSITIONS FOR INHIBITING THE HYDROLYTIC ACTIVITY OF ENDOGENOUS MATRIX METALLOPROTEINASES IN DENTAL RESTORATIONS BISCO, INC. (US) 2011-09-01 WO claimed
US-20110207844-A1 Benzalkonium chloride compositions for inhibiting the hydrolytic activity of endogenous matrix metalloproteinases in dental restorations BISCO, INC. 2011-08-25 US claimed
CN-101327167-B Use of hydroxylapatite crystal whisker with modified surface UNIV KUNMING SCIENCE & TECHNOLOGY 2011-06-08 CN claimed
US-20110003266-A1 HARDENABLE SELF-SUPPORTING STRUCTURES AND METHODS 3M INNOVATIVE PROPERTIES COMPANY 2011-01-06 US claimed
US-6786720-B1 Epoxy resin bonding pad for a ceramic orthodontic appliance TP ORTHODONTICS, INC. 2004-09-07 US claimed
EP-1352617-A1 Epoxy resin bonding pad for a ceramic orthodontic appliance TP ORTHODONTICS, INC. (US) 2003-10-15 EP claimed
CN-109880560-A A kind of block functionality bonding polymer and preparation method thereof 点铂医疗科技(常州)有限公司 2019-06-14 CN disclosed
CN-109233702-A A kind of parents' modified acrylic ester copolymer bonding agent and preparation method thereof 点铂医疗科技(常州)有限公司 2019-01-18 CN disclosed
EP-0459361-A1 Dental filling band Din, Franklin M. (US) 1991-12-04 EP disclosed
US-5035615-A Dental filling band and method of use DIN FRANKLIN (US) 1991-07-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110003266-A1 HARDENABLE SELF-SUPPORTING STRUCTURES AND METHODS DNA2, SMARCA2, SMCHD1 ALDH1A1 3908/4885MGLL 706/4885TDP1 1149/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.