SCHEMBL345072

SCHEMBL345072

C=C(C)C(=O)OCCCCCCCCCCCCOP(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.62
LPAR3 Q9UBY5 8/20 0.53
LPAR2 Q9HBW0 6/20 0.53
LPAR1 Q92633 4/20 0.53
POLB P06746 1/20 0.48
APEX1 P27695 1/20 0.48
HTT P42858 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
THRB P10828 1/20 0.46
ALDH1A1 P00352 1/20 0.40
BTN3A1 O00481 1/20 0.36

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
SCHEMBL30617843 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL1653308 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL15795 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL346866 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL15166 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL345787 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL345385 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL346923 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL1651991 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL345903 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2492289-B1 POLYMERIZABLE COMPOSITION AND DENTAL MATERIAL KURARAY NORITAKE DENTAL INC (JP) 2020-03-18 EP claimed
US-9333148-B2 Polymerizable composition and dental material KURARAY NORITAKE DENTAL INC. (JP) 2016-05-10 US claimed
US-8329845-B2 Divided redox-curing type composition KURARAY NORITAKE DENTAL INC. (JP) 2012-12-11 US claimed
US-6984673-B2 Dental cement composition KURARAY CO., LTD. (JP) 2006-01-10 US claimed
US-20040176496-A1 Light-curing dental adhesive compositions DENTKIST, INC. (KR) 2004-09-09 US claimed
EP-4736834-A1 DENTAL COMPOSITION KIT Kuraray Noritake Dental Inc. (JP) 2026-05-06 EP disclosed
US-20260053717-A1 CARIOUS TOOTH STRUCTURE RECOVERY AGENT, AND DENTAL ADHESIVE KIT KURARAY NORITAKE DENTAL INC. (JP) 2026-02-26 US disclosed
EP-4659730-A1 DENTAL COMPOSITION Kuraray Noritake Dental Inc. (JP) 2025-12-10 EP disclosed
EP-4585202-A1 CARIOUS TOOTH STRUCTURE RECOVERY AGENT, AND DENTAL ADHESIVE KIT Kuraray Noritake Dental Inc. (JP) 2025-07-16 EP disclosed
WO-2025004938-A1 DENTAL COMPOSITION KIT クラレノリタケデンタル株式会社 2025-01-02 WO disclosed
WO-2024162465-A1 DENTAL COMPOSITION クラレノリタケデンタル株式会社 2024-08-08 WO disclosed
WO-2024150826-A1 DENTAL COMPOSITION クラレノリタケデンタル株式会社 2024-07-18 WO disclosed
US-4612384-A Phosphate monoester adhesive composition KURARAY CO., LTD. (JP) 1986-09-16 US disclosed
EP-0074708-B1 ADHESIVE COMPOSITION KURARAY CO., LTD. (JP) 1986-02-19 EP disclosed
US-4563486-A DENTISTRY IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-01-07 US disclosed
US-4539382-A ACRYLIC PHOSPHORIC ACID DERIVATIVE KURARAY CO., LTD. (JP) 1985-09-03 US disclosed
US-4525493-A CONTAINING UNSATURATED CARBOXYLATED PHOSPHORUS-OXYGEN COMPOUNDS KURARAY CO., LTD. (JP) 1985-06-25 US disclosed
EP-0132929-A1 Polymerisable composition IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-02-13 EP disclosed
EP-0115948-A1 Adhesive composition KURARAY CO., LTD. (JP) 1984-08-15 EP disclosed
EP-0074708-A2 Adhesive composition KURARAY CO., LTD. (JP) 1983-03-23 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 (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-20260053717-A1 CARIOUS TOOTH STRUCTURE RECOVERY AGENT, AND DENTAL ADHESIVE KIT ITGA1, TAS1R1, KATNA1 TSHR 1960/4885LPAR3 2639/4885LPAR2 3213/4885
US-20040176496-A1 Light-curing dental adhesive compositions HBG2, GRIN2A, HBG1 TSHR 4149/4885LPAR3 1340/4885LPAR2 1765/4885

“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.