SCHEMBL345789

SCHEMBL345789

C=C(C)C(=O)OCCCCOC(=O)c1cc(C(=O)O)ccc1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.61
HTT P42858 2/20 0.61
POLB P06746 1/20 0.61
APEX1 P27695 1/20 0.61
TSHR P16473 6/20 0.45
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 2/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PPARA Q07869 1/20 0.39
GPR35 Q9HC97 1/20 0.39
HDAC6 Q9UBN7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RAB9A P51151 1/20 0.37
PTPN11 Q06124 1/20 0.37

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
SCHEMBL543628 0.96 POLB (0.56) TDP1HTTPOLBAPEX1TSHR
SCHEMBL2787758 0.92 POLB (0.52) TDP1HTTPOLBAPEX1TSHR
SCHEMBL14262486 0.92 TDP1 (0.57) TDP1HTTPOLBAPEX1TSHR
SCHEMBL31053930 0.90 TDP1 (0.56) TDP1HTTPOLBAPEX1TSHR
SCHEMBL544688 0.90 TDP1 (0.56) TDP1HTTPOLBAPEX1TSHR
SCHEMBL14262501 0.90 POLB (0.49) TDP1HTTPOLBAPEX1TSHR
SCHEMBL11228078 0.89 TDP1 (0.54) TDP1HTTPOLBAPEX1TSHR
SCHEMBL14262495 0.89 POLB (0.48) TDP1HTTPOLBAPEX1TSHR
SCHEMBL18812871 0.89 TDP1 (0.53) TDP1HTTPOLBAPEX1TSHR
SCHEMBL14262496 0.87 POLB (0.46) TDP1HTTPOLBAPEX1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329845-B2 Divided redox-curing type composition KURARAY NORITAKE DENTAL INC. (JP) 2012-12-11 US claimed
EP-3848418-B1 DENTAL CURABLE COMPOSITION AND METHOD FOR PRODUCING DENTAL CURABLE COMPOSITION TOKUYAMA DENTAL CORP (JP) 2024-05-22 EP disclosed
WO-2024053223-A1 CARIOUS TOOTH STRUCTURE RECOVERY AGENT, AND DENTAL ADHESIVE KIT クラレノリタケデンタル株式会社 2024-03-14 WO disclosed
EP-3936109-B1 SOLVENT-FREE ADHESIVE COMPOSITION FOR DENTAL USE KURARAY NORITAKE DENTAL INC (JP) 2024-02-14 EP disclosed
CN-112545900-B Dental curable composition containing transition metal adsorbent 株式会社松风 2024-02-13 CN disclosed
WO-2024029508-A1 KIT FOR PREPARING CURABLE COMPOSITION FOR DENTAL MATERIAL, CURABLE COMPOSITION FOR DENTAL MATERIAL, AND DENTAL MATERIAL 三井化学株式会社 2024-02-08 WO disclosed
WO-2024029507-A1 CURABLE COMPOSITION PREPARATION KIT, CURABLE COMPOSITION, CURED ARTICLE, AND DENTAL MATERIAL 三井化学株式会社 2024-02-08 WO disclosed
US-11802237-B2 Method for producing powder containing zirconia particles and fluorescent agent KURARAY NORITAKE DENTAL INC. (JP) 2023-10-31 US disclosed
CN-116916872-A Dental composition 可乐丽则武齿科株式会社 2023-10-20 CN disclosed
WO-2023191113-A1 SELF-ADHESIVE COMPOSITE RESIN FOR DENTAL USE クラレノリタケデンタル株式会社 2023-10-05 WO disclosed
US-20120016094-A1 REDOX-CURING TYPE COMPOSITION KURARAY MEDICAL INC. (JP) 2012-01-19 US disclosed
US-20100267856-A1 CEMENT FOR DENTAL APPLICATIONS KURARAY MEDICAL INC. (JP) 2010-10-21 US disclosed
EP-2226060-A1 CEMENT FOR DENTAL APPLICATIONS Kuraray Medical Inc. (JP) 2010-09-08 EP disclosed
US-20100087613-A1 DIVIDED REDOX-CURING TYPE COMPOSITION KURARAY MEDICAL INC. (JP) 2010-04-08 US disclosed
US-20100076157-A1 NOVEL COMPOUND, COMPOSITION COMPRISING THE SAME, AND PROCESS FOR PRODUCTION OF POLYMERIZABLE AMIDE KURARAY MEDICAL INC. (JP) 2010-03-25 US disclosed
EP-2110392-A1 MULTI-PART REDOX-CURING-TYPE COMPOSITION Kuraray Medical Inc. (JP) 2009-10-21 EP disclosed
EP-2070935-A1 NOVEL COMPOUND, COMPOSITION COMPRISING THE SAME, AND PROCESS FOR PRODUCTION OF POLYMERIZABLE AMIDE Kuraray Medical Inc. (JP) 2009-06-17 EP disclosed
EP-1431315-B1 Photopolymerization initiator and photopolymerizable composition TOKUYAMA CORP (JP) 2007-10-17 EP disclosed
US-20040186195-A1 Photopolymerization initiator and photopolymerizable composition TOKUYAMA CORPORATION (JP) 2004-09-23 US disclosed
EP-1431315-A2 Photopolymerization initiator and photopolymerizable composition Tokuyama Corporation (JP) 2004-06-23 EP 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-20100076157-A1 NOVEL COMPOUND, COMPOSITION COMPRISING THE SAME, AND PROCESS FOR PRODUCTION OF POLYMERIZABLE AMIDE H1-0, H1-4, H1-2 TDP1 3732/4885HTT 3341/4885POLB 677/4885

“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.