SCHEMBL144845

SCHEMBL144845

CC=CC(=O)OCC(O)COCCOCC(O)COC(=O)C=CC

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.36
ATM Q13315 1/20 0.34
TSHR P16473 3/20 0.33
GSTP1 P09211 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 3/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP1A2 P05177 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
USP2 O75604 2/20 0.31
CYP3A4 P08684 2/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL21081997 0.98 HCAR2 (0.35) HCAR2ATMTSHRGSTP1LPAR5
SCHEMBL26109047 0.98 HCAR2 (0.35) HCAR2ATMTSHRGSTP1LPAR5
SCHEMBL21081994 0.98 HCAR2 (0.35) HCAR2ATMTSHRGSTP1LPAR5
SCHEMBL28138681 0.93 HSD17B10 (0.42) HCAR2ATMLPAR5HSD17B10CYP1A2
SCHEMBL1046295 0.93 LPAR5 (0.41) HCAR2ATMTSHRGSTP1LPAR5
SCHEMBL996290 0.93 LPAR5 (0.37) HCAR2ATMTSHRGSTP1LPAR5
SCHEMBL5535259 0.92 TSHR (0.35) HCAR2ATMTSHRGSTP1ALDH1A1
SCHEMBL347488 0.92 TSHR (0.35) HCAR2ATMTSHRGSTP1ALDH1A1
SCHEMBL21081955 0.91 LPAR5 (0.43) HCAR2ATMTSHRLPAR5ALDH1A1
SCHEMBL21081952 0.91 LPAR5 (0.43) HCAR2ATMTSHRLPAR5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2110392-B1 DIVIDED REDOX-CURING-TYPE COMPOSITION KURARAY NORITAKE DENTAL INC (JP) 2020-05-06 EP claimed
EP-2835128-B1 ONE-PACK DENTAL ADHESIVE KURARAY NORITAKE DENTAL INC (JP) 2020-01-08 EP claimed
US-9700491-B2 One-part dental adhesive KURARAY NORITAKE DENTAL INC. (JP) 2017-07-11 US claimed
US-20150094392-A1 ONE-PART DENTAL ADHESIVE KURARAY NORITAKE DENTAL INC. (JP) 2015-04-02 US claimed
EP-2835128-A1 ONE-PACK DENTAL ADHESIVE Kuraray Noritake Dental Inc. (JP) 2015-02-11 EP claimed
US-8895680-B2 Redox curing-type nonaqueous curable composition KURARAY NORITAKE DENTAL INC. (JP) 2014-11-25 US claimed
US-8329845-B2 Divided redox-curing type composition KURARAY NORITAKE DENTAL INC. (JP) 2012-12-11 US claimed
US-20100240798-A1 REDOX-CURING TYPE NONAQUEOUS CURABLE COMPOSITION KURARAY MEDICAL INC. (JP) 2010-09-23 US claimed
US-20100087613-A1 DIVIDED REDOX-CURING TYPE COMPOSITION KURARAY MEDICAL INC. (JP) 2010-04-08 US claimed
EP-2110392-A1 MULTI-PART REDOX-CURING-TYPE COMPOSITION Kuraray Medical Inc. (JP) 2009-10-21 EP claimed
EP-0468077-A1 Dental adhesive MITSUBISHI RAYON CO., LTD. (JP) 1992-01-29 EP claimed
EP-0413174-A2 Dental adhesive composition MITSUBISHI RAYON CO., LTD. (JP) 1991-02-20 EP claimed
US-4923905-A DIKETONE AND POLYPEROXY ESTER OF BENZOPHENONE POLYMERIZATION INITIATOR NIPPON OIL AND FATS CO., LTD. (JP) 1990-05-08 US claimed
EP-0176777-B1 LIGHT CURABLE DENTAL COMPOSITION NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-11-23 EP claimed
US-4824876-A ORGANIC PEROXIDE, PYRYLIUM SALT INIATOR NIPPON OIL AND FATS CO., LTD. (JP) 1989-04-25 US claimed
US-4746685-A METHACRYLATE COMPOUND WITH AN ORGANIC PEROXIDE AND PYRYCIUM SALT AS A LIGHT POLYMERIZATION NIPPON OIL AND FATS CO., LTD. (JP) 1988-05-24 US claimed
EP-0176777-A2 Light curable dental composition NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-04-09 EP claimed
US-4386912-A Method for filling tooth cavities employing a polymerizable urethane cement composition KURARAY COMPANY LIMITED (JP) 1983-06-07 US claimed
US-4347174-A Cement compositions KURARAY COMPANY, LIMITED (JP) 1982-08-31 US claimed
US-4302381-A Dental material KURARAY CO., LTD. (JP) 1981-11-24 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-20100240798-A1 REDOX-CURING TYPE NONAQUEOUS CURABLE COMPOSITION LPO, CDH1, GPX4 HCAR2 1655/4885ATM 3305/4885TSHR 4823/4885
US-20150094392-A1 ONE-PART DENTAL ADHESIVE ARID2, ICAM1, CAD HCAR2 1087/4885ATM 1325/4885TSHR 4323/4885

“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.