SCHEMBL8200686

SCHEMBL8200686

C=C(C)C(=O)OC(CC)CCO

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
ALDH1A1 P00352 2/20 0.37
THRB P10828 1/20 0.36
PRKCA P17252 2/20 0.35
PRKCD Q05655 2/20 0.35
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL9327223 0.87 TSHR (0.42) TSHRALDH1A1THRBPRKCAPRKCD
SCHEMBL440084 0.86 ALDH1A1 (0.43) TSHRALDH1A1THRBPRKCAPRKCD
SCHEMBL8022030 0.86 TSHR (0.39) TSHRALDH1A1THRBPRKCAPRKCD
SCHEMBL440616 0.86 TSHR (0.45) TSHRALDH1A1THRB
SCHEMBL154112 0.85 TSHR (0.49) TSHRPRKCAPRKCDMAPTMAPK1
SCHEMBL1427012 0.85 TSHR (0.38) TSHRALDH1A1THRBPRKCAPRKCD
SCHEMBL27883649 0.85 TSHR (0.38) TSHRALDH1A1THRBPRKCAPRKCD
SCHEMBL159608 0.84 TSHR (0.41) TSHRALDH1A1THRBPRKCAPRKCD
SCHEMBL28697418 0.84 TSHR (0.51) TSHRPRKCAPRKCDMAPTMAPK1
SCHEMBL28526610 0.84 TSHR (0.51) TSHRPRKCAPRKCDMAPTMAPK1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250017827-A1 Acid-Stable Glass Fillers And Self-Adhesive Dental Composite Cements With Good Transparency Containing Them IVOCLAR VIVADENT AG (LI) 2025-01-16 US claimed
EP-4488243-A1 ACID-STABLE GLASS FILLERS AND SELF-ADHESIVE DENTAL COMPOSITE CEMENTS CONTAINING SAME HAVING GOOD TRANSPARENCY Ivoclar Vivadent AG (LI) 2025-01-08 EP claimed
EP-4205723-A1 HIGH TRANSPARENCY, SULPHATE-CONTAINING OR PHOSPHATE-CONTAINING DENTAL SELF-ADHERING COMPOSITE Ivoclar Vivadent AG (LI) 2023-07-05 EP claimed
EP-4205724-A1 SELF-ADHESIVE DENTAL COMPOSITE CEMENTS WITH GOOD TRANSPARENCY BASED ON ACID-TREATED FILLERS Ivoclar Vivadent AG (LI) 2023-07-05 EP claimed
EP-4205722-A1 SELF-ADHESIVE DENTAL COMPOSITE WITH GOOD TRANSPARENCY Ivoclar Vivadent AG (LI) 2023-07-05 EP claimed
US-20230203224-A1 SULFATE-CONTAINING OR PHOSPHATE-CONTAINING, SELF-ADHESIVE DENTAL COMPOSITE CEMENT WITH GOOD TRANSPARENCY IVOCLAR VIVADENT AG (LI) 2023-06-29 US claimed
US-20230201082-A1 SELF-ADHESIVE DENTAL COMPOSITE CEMENT WITH GOOD TRANSPARENCY IVOCLAR VIVADENT AG (LI) 2023-06-29 US claimed
US-6063830-A SILICA AND URETHANEACRYLATE KABUSHIKI KAISHA SHOFU (JP) 2000-05-16 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 (3 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-20230203224-A1 SULFATE-CONTAINING OR PHOSPHATE-CONTAINING, SELF-ADHESIVE DENTAL COMPOSITE CEMENT WITH GOOD TRANSPARENCY CD44, SSRP1, VCL TSHR 4050/4885ALDH1A1 2653/4885THRB 3027/4885
US-20230201082-A1 SELF-ADHESIVE DENTAL COMPOSITE CEMENT WITH GOOD TRANSPARENCY ITGA1, CDH1, ITGA5 TSHR 3676/4885ALDH1A1 1267/4885THRB 3225/4885
US-20250017827-A1 Acid-Stable Glass Fillers And Self-Adhesive Dental Composite Cements With Good Transparency Containing Them HAO2, HAO1, CDH1 TSHR 4061/4885ALDH1A1 1494/4885THRB 3438/4885

“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.