SCHEMBL345559

SCHEMBL345559

C=C(C)C(=O)OCCOP(=O)(OCCOC(=O)C(=C)C)OP(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.49
TSHR P16473 3/20 0.43
BTN3A1 O00481 3/20 0.42
ALDH1A1 P00352 2/20 0.39
TDP1 Q9NUW8 2/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
MVD P53602 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
FDPS P14324 1/20 0.30
BLM P54132 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
SCHEMBL4010567 0.91 THRB (0.53) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL15709964 0.90 TSHR (0.49) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL6861002 0.90 TSHR (0.53) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL23002887 0.89 TSHR (0.56) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL5744786 0.89 TSHR (0.56) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL15302389 0.89 TSHR (0.56) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL5746182 0.89 TSHR (0.56) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL4001460 0.88 THRB (0.47) THRBTSHRBTN3A1ALDH1A1TDP1
Phosphoric Acid SCHEMBL18787889 0.87 THRB (0.53) THRBTSHRBTN3A1ALDH1A1TDP1
SCHEMBL41530 0.87 THRB (0.57) THRBTSHRBTN3A1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12441821-B2 (Meth)acrylate and use thereof MITSUI CHEMICALS, INC. (JP) 2025-10-14 US disclosed
US-20250122315-A1 (METH)ACRYLATE AND USE THEREOF MITSUI CHEMICALS, INC. (JP) 2025-04-17 US disclosed
EP-3603606-B1 ADHESIVE MONOMER FOR DENTAL MATERIAL MITSUI CHEMICALS INC (JP) 2024-11-13 EP disclosed
EP-3719043-B1 (METH)ACRYLATE, MONOMER COMPOSITION, DENTAL MATERIAL OBTAINED FROM SAID COMPOSITION, AND PRODUCTION METHOD THEREOF MITSUI CHEMICALS INC (JP) 2024-11-13 EP disclosed
US-20240189195-A1 DENTAL POLYMERIZABLE COMPOSITION GC CORPORATION (JP) 2024-06-13 US disclosed
US-11992538-B2 Polymerizable dental composition based on condensed silanes VOCO GMBH (DE) 2024-05-28 US disclosed
US-20240164993-A1 ORGANOSILICON COMPOUND AND DENTAL COMPOSITION CONTAINING SAME KURARAY NORITAKE DENTAL INC. (JP) 2024-05-23 US disclosed
US-20240108554-A1 DENTAL ADHESIVE COMPOSITION GC CORPORATION (JP) 2024-04-04 US disclosed
EP-3047839-B1 FILLER TREATED WITH AN ACIDIC POLYMER SHOFU INC (JP) 2024-03-13 EP disclosed
EP-3936109-B1 SOLVENT-FREE ADHESIVE COMPOSITION FOR DENTAL USE KURARAY NORITAKE DENTAL INC (JP) 2024-02-14 EP disclosed
EP-1285947-A1 ANTIMICROBIAL COMPOSITION KURARAY CO., LTD. (JP) 2003-02-26 EP disclosed
EP-1269968-A1 Dental cement composition KURARAY CO., LTD. (JP) 2003-01-02 EP disclosed
EP-1269967-A1 Dental composition kit KURARAY CO., LTD. (JP) 2003-01-02 EP disclosed
EP-1270688-A1 FILLINGS AND COMPOSITE DENTAL MATERIALS CONTAINING THE FILLINGS KURARAY CO., LTD. (JP) 2003-01-02 EP disclosed
US-20020198284-A1 Adhesive composition KURARAY CO. LTD, (JP) 2002-12-26 US disclosed
EP-1262530-A1 ADHESIVE COMPOSITION KURARAY CO., LTD. (JP) 2002-12-04 EP disclosed
US-20020035169-A1 Bonding compositions for dental use KURARAY CO., LTD (JP) 2002-03-21 US disclosed
US-6355704-B1 BACTERICIDE PRIMERS; BONDING TO TEETH KURARAY CO., LTD. (JP) 2002-03-12 US disclosed
EP-1101484-A2 Dental fillers KABUSHIKI KAISHA SHOFU (JP) 2001-05-23 EP disclosed
EP-0980682-A1 Bonding compositions for dental use KURARAY CO., LTD. (JP) 2000-02-23 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 (5 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-20020035169-A1 Bonding compositions for dental use PTK2, DEK, POLK THRB 3603/4885TSHR 4726/4885BTN3A1 2602/4885
US-11992538-B2 Polymerizable dental composition based on condensed silanes NCAPH, RCC1, NCAPD2 THRB 4522/4885TSHR 4596/4885BTN3A1 240/4885
US-20250122315-A1 (METH)ACRYLATE AND USE THEREOF TST, MMAB, BHMT2 THRB 1006/4885TSHR 2952/4885BTN3A1 1557/4885
US-12441821-B2 (Meth)acrylate and use thereof TST, MMAB, BHMT2 THRB 1006/4885TSHR 2952/4885BTN3A1 1557/4885
US-20240164993-A1 ORGANOSILICON COMPOUND AND DENTAL COMPOSITION CONTAINING SAME MSL1, ITGA1, ASH2L THRB 3818/4885TSHR 4172/4885BTN3A1 1348/4885

“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.