SCHEMBL4459705

SCHEMBL4459705

C=C(C)COC(=O)OCC

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.62
SOAT1 P35610 1/20 0.50
LMNA P02545 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TSHR P16473 2/20 0.39
ALOX15 P16050 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
THRB P10828 2/20 0.38
MAPT P10636 2/20 0.36
TRPA1 O75762 1/20 0.36
GLO1 Q04760 1/20 0.35
PKM P14618 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.33

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
SCHEMBL1976400 0.90 ALDH1A1 (0.43) ALDH1A1SOAT1LMNAHSD17B10TSHR
SCHEMBL1058983 0.83 ALDH1A1 (0.65) ALDH1A1SOAT1LMNAHSD17B10TSHR
SCHEMBL10902535 0.83 THRB (0.39) ALDH1A1LMNAHSD17B10TSHRTHRB
SCHEMBL28494618 0.80 ALDH1A1 (0.48) ALDH1A1SOAT1LMNAHSD17B10TSHR
SCHEMBL10790003 0.80 ALDH1A1 (0.33) ALDH1A1SOAT1LMNAHSD17B10TSHR
SCHEMBL14260457 0.80 ALDH1A1 (0.68) ALDH1A1SOAT1LMNAHSD17B10TSHR
SCHEMBL9451741 0.79 TSHR (0.44) ALDH1A1TSHRTHRBHTT
Ethylene SCHEMBL27520492 0.79 ALDH1A1 (0.87) ALDH1A1SOAT1LMNAHSD17B10TSHR
Formaldehyde SCHEMBL28152488 0.79 ALDH1A1 (0.87) ALDH1A1SOAT1LMNAHSD17B10TSHR
SCHEMBL3673 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336575-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-10-10 US disclosed
US-20240336740-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-10-10 US disclosed
US-20240327341-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-10-03 US disclosed
CN-118401566-A Polythiol compound and process for producing the same 汉高股份有限及两合公司 2024-07-26 CN disclosed
CN-118401498-A Polythiol compound and process for producing the same 汉高股份有限及两合公司 2024-07-26 CN disclosed
EP-4198062-B1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-07-17 EP disclosed
EP-4198028-B1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-07-17 EP disclosed
WO-2023110273-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO. KGAA (DE) 2023-06-22 WO disclosed
WO-2023110270-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO. KGAA (DE) 2023-06-22 WO disclosed
WO-2023110271-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO. KGAA (DE) 2023-06-22 WO disclosed
US-5986031-A Process for making allylic copolymer resins ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1999-11-16 US disclosed
US-5919874-A Process for making hydroxy-functional acrylic resins having low residual allyl monomer content ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1999-07-06 US disclosed
WO-1999006452-A1 PROCESS FOR MAKING HYDROXY-FUNCTIONAL ACRYLIC RESINS HAVING LOW RESIDUAL ALLYL MONOMER CONTENT ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1999-02-11 WO disclosed
EP-0404497-B1 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO (JP) 1994-06-01 EP disclosed
EP-0428343-B1 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO (JP) 1994-05-04 EP disclosed
US-5118863-A Process for producing an α,β-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1992-06-02 US disclosed
EP-0428343-A1 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1991-05-22 EP disclosed
EP-0404497-A2 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1990-12-27 EP disclosed
US-4450285-A CARBONYLATION OF UNSATURATED CARBONATE WITH CARBON MONOXIDE THE DOW CHEMICAL COMPANY (US) 1984-05-22 US disclosed
US-4362670-A Allylation of carbon compounds THE DOW CHEMICAL COMPANY (US) 1982-12-07 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 (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-20240336575-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF VRK2, VRK1, PTMS ALDH1A1 4626/4885SOAT1 3098/4885LMNA 2483/4885
US-20240327341-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF VCL, C9, VRK1 ALDH1A1 2029/4885SOAT1 1762/4885LMNA 1075/4885

“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.