SCHEMBL29940900

SCHEMBL29940900

C=C(C)C(=O)OCCSCCCCCCSCCOC(=O)C(=C)C

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
THRB P10828 2/20 0.48
POLB P06746 2/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 2/20 0.38
CES2 O00748 3/20 0.37
GMNN O75496 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
BLM P54132 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ACHE P22303 3/20 0.33
PLA2G4B P0C869 1/20 0.30
FAAH O00519 4/20 0.30
CES1 P23141 4/20 0.30
PLA2G6 O60733 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
SCHEMBL10427136 0.98 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL10427163 0.94 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL491146 0.93 TSHR (0.69) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11420004 0.93 TSHR (0.69) TSHRTHRBPOLBAPEX1HTT
SCHEMBL7646477 0.93 TSHR (0.69) TSHRTHRBPOLBAPEX1HTT
SCHEMBL212008 0.92 THRB (0.55) TSHRTHRBPOLBAPEX1HTT
SCHEMBL14993242 0.90 TSHR (0.63) TSHRTHRBPOLBAPEX1HTT
SCHEMBL9073332 0.90 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL673043 0.90 THRB (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL670913 0.90 THRB (0.53) TSHRTHRBPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260140398-A1 OPTICAL MATERIAL COMPOSITION, CURED BODY, OPTICAL ARTICLE, LENS, AND SPECTACLES TOKUYAMA CORPORATION (JP) 2026-05-21 US disclosed
EP-4603522-A1 OPTICAL MATERIAL COMPOSITION, CURED BODY, OPTICAL ARTICLE, LENS, AND SPECTACLES TOKUYAMA CORPORATION (JP) 2025-08-20 EP disclosed
CN-114829539-B Photochromic curable composition and photochromic optical article 株式会社德山 2024-09-06 CN disclosed
CN-114846047-B Moisture-curable polyurethane composition and laminate 株式会社德山 2024-08-30 CN disclosed
CN-111936524-B Photochromic curable composition 株式会社德山 2022-09-23 CN 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-20260140398-A1 OPTICAL MATERIAL COMPOSITION, CURED BODY, OPTICAL ARTICLE, LENS, AND SPECTACLES CRYAA, FEM1B, MAPRE1 TSHR 4218/4885THRB 3916/4885POLB 3133/4885

“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.