SCHEMBL671634

SCHEMBL671634

C=CC(=O)OCC(O)COCC(O)COCC1CO1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.41
ALDH1A1 P00352 7/20 0.41
TP53 P04637 4/20 0.36
HIF1A Q16665 3/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP3A4 P08684 3/20 0.34
MGLL Q99685 1/20 0.32
MAPK1 P28482 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
HPGD P15428 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
SCHEMBL9242015 0.98 TSHR (0.42) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL22245749 0.92 TSHR (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4847032 0.89 TSHR (0.47) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL28954002 0.88 TSHR (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL24899647 0.88 THRB (0.37) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL24899844 0.88 THRB (0.37) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7867278 0.87 TSHR (0.42) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL24897227 0.86 TSHR (0.31) TSHRALDH1A1
SCHEMBL24897515 0.86 TSHR (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL22245968 0.84 TSHR (0.40) TSHRALDH1A1TP53HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194511-B1 COMPRISING POLYMERIZABLE MONOMER CONTAINING SULFUR-CONTAINING (METH)ACRYLATE POLYMERIZABLE MONOMER AND PHOTOCHROMIC COMPOUND TOKUYAMA CORPORATION (JP) 2001-02-27 US claimed
US-5776376-A BLEND OF EPOXY AND UNSATURATED ESTER MONOMERS TOKUYAMA CORPORATION (JP) 1998-07-07 US claimed
EP-0559439-B1 Photochromic composition TOKUYAMA CORP (JP) 1997-06-04 EP claimed
US-5395566-A Addition polymerizable composition, epoxy monomer, imide or anhydride containing fused ring photochromic compound, lenses TOKUYAMA CORPORATION (JP) 1995-03-07 US claimed
EP-0619358-A1 Photochromic composition TOKUYAMA CORPORATION (JP) 1994-10-12 EP claimed
EP-0559439-A2 Photochromic composition TOKUYAMA CORPORATION (JP) 1993-09-08 EP claimed
EP-4692072-A1 PHOTOCHROMIC COMPOUND, PROPARGYL ALCOHOL COMPOUND, CURABLE COMPOSITION, OPTICAL ARTICLE, LENS, AND SPECTACLES TOKUYAMA CORPORATION (JP) 2026-02-11 EP disclosed
US-20250355282-A1 LAYERED BODY, OPTICAL ARTICLE, LENS, AND SPECTACLES TOKUYAMA CORPORATION (JP) 2025-11-20 US disclosed
US-12434265-B2 Coating method TOKUYAMA CORPORATION (JP) 2025-10-07 US disclosed
EP-4560367-A1 LAYERED BODY, OPTICAL ARTICLE, LENS, AND SPECTACLES TOKUYAMA CORPORATION (JP) 2025-05-28 EP disclosed
CN-114402008-B Photochromic hydroxy carbamate compound 株式会社德山 2024-07-19 CN disclosed
CN-115702176-B Curable composition and cured product thereof 株式会社德山 2024-05-03 CN disclosed
WO-2024018902-A1 LAYERED BODY, OPTICAL ARTICLE, LENS, AND SPECTACLES 株式会社トクヤマ 2024-01-25 WO disclosed
US-5776376-A BLEND OF EPOXY AND UNSATURATED ESTER MONOMERS TOKUYAMA CORPORATION (JP) 1998-07-07 US disclosed
US-5708063-A REVERSABLE COLOR COMPOUNDS TOKUYAMA CORPORATION (JP) 1998-01-13 US disclosed
US-5631382-A PHOTOCHROMIC LENSES TOKUYAMA CORPORATION (JP) 1997-05-20 US disclosed
EP-0773272-A1 PHOTOCHROMIC CURABLE COMPOSITION TOKUYAMA CORPORATION (JP) 1997-05-14 EP disclosed
EP-0773273-A1 PROCESS FOR THE PRODUCTION OF PHOTOCHROMIC PRODUCT OF CURING TOKUYAMA CORPORATION (JP) 1997-05-14 EP disclosed
EP-0696582-A1 Polycyclic spirophthalimide derivatives, process for their preparation and their use as fulgimides TOKUYAMA CORPORATION (JP) 1996-02-14 EP disclosed
EP-0629626-A2 Cyclopropyl-substituted spiro-photochromic compounds TOKUYAMA CORPORATION (JP) 1994-12-21 EP disclosed