SCHEMBL6784539

SCHEMBL6784539

C=CC(=O)O[CH]CCCC

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 11/20 0.53
HPGD P15428 1/20 0.53
THRB P10828 5/20 0.41
ALDH1A1 P00352 5/20 0.41
CYP3A4 P08684 1/20 0.39
ATM Q13315 1/20 0.38
THRA P10827 2/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
F7 P08709 1/20 0.34
F3 P13726 1/20 0.34
HCAR2 Q8TDS4 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
SCHEMBL4919084 0.94 TSHR (0.52) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL6045859 0.92 TSHR (0.50) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL20917083 0.92 TSHR (0.50) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL7103515 0.92 TSHR (0.50) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL6259527 0.92 TSHR (0.50) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL767709 0.87
SCHEMBL865154 0.81 TSHR (0.40) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL1975528 0.80 TSHR (0.50) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL1975527 0.80 TSHR (0.50) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL866991 0.79 TSHR (0.39) TSHRHPGDALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113785005-B Curing composition 美国圣戈班性能塑料公司 2023-12-12 CN disclosed
CN-116323726-A Active energy ray-curable composition, cured product, lens, and camera module DIC株式会社 2023-06-23 CN disclosed
CN-109478595-B Organic thin film transistor, organic semiconductor film, compound, composition for organic thin film transistor, and method for manufacturing organic thin film transistor 富士胶片株式会社 2023-02-07 CN disclosed
CN-114401966-A Method for producing cyclic imide compound, composition, compound 富士胶片株式会社 2022-04-26 CN disclosed
CN-113785005-A Curing composition 美国圣戈班性能塑料公司 2021-12-10 CN disclosed
CN-113728449-A Composition comprising a metal oxide and a metal oxide 富士胶片株式会社 2021-11-30 CN disclosed
CN-113692653-A Ink composition for manufacturing organic semiconductor device 株式会社大赛璐 2021-11-23 CN disclosed
CN-108912011-B Photoalignment material 罗立克科技股份公司 2021-09-24 CN disclosed
CN-112771684-A Ink composition for manufacturing organic semiconductor device 株式会社大赛璐 2021-05-07 CN disclosed
WO-2021070646-A1 ORGANIC THIN FILM TRANSISTOR, POLYMER, COMPOSITION, ORGANIC SEMICONDUCTOR FILM AND COMPOUND 富士フイルム株式会社 2021-04-15 WO disclosed
CN-111542939-A Organic semiconductor element, organic semiconductor composition, organic semiconductor film, method for producing organic semiconductor film, and polymer for use in these 富士胶片株式会社 2020-08-14 CN disclosed
US-20040259992-A1 Two-component adhesion promoter combination of an unsaturated alkoxysilane and a mercaptoalkyl alkoxysilane, for use in dental prostheses 3M ESPE AG (DE) 2004-12-23 US disclosed
EP-0757707-A1 THIAZOLE METHINE DYES BASF AKTIENGESELLSCHAFT (DE) 1997-02-12 EP disclosed
WO-1995029958-A1 THIAZOLE METHINE DYES BASF AKTIENGESELLSCHAFT (DE) 1995-11-09 WO disclosed
WO-1995020181-A1 METHINE DYES FOR NON-LINEAR OPTICS BASF AKTIENGESELLSCHAFT (DE) 1995-07-27 WO 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-20040259992-A1 Two-component adhesion promoter combination of an unsaturated alkoxysilane and a mercaptoalkyl alkoxysilane, for use in dental prostheses ITGA2, ITGB2, ITGA2B TSHR 3882/4885HPGD 996/4885THRB 1594/4885

“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.