SCHEMBL21462872

SCHEMBL21462872

CCC(S)SCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
RAB9A P51151 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
CYP1A2 P05177 2/20 0.37
TRPA1 O75762 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
PRMT1 Q99873 1/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP2C9 P11712 1/20 0.37
S100A4 P26447 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL8818691 0.89 EPHX1 (0.35) POLBALDH1A1CYP2C9SMN1; SMN2
SCHEMBL23998029 0.78 TP53 (0.44) TP53RAB9APPARGPPARACYP1A2
SCHEMBL4850434 0.78 PPARG (0.42) PPARGPPARACYP1A2CYP3A4CYP2D6
SCHEMBL19062324 0.77 TRPA1 (0.42) TP53PPARGPPARACYP1A2TRPA1
SCHEMBL10974168 0.76 SIGMAR1 (0.41) TP53RAB9APPARGPPARACYP1A2
SCHEMBL27454839 0.75 TRPA1 (0.46) TP53PPARGPPARACYP1A2TRPA1
SCHEMBL19592252 0.73 POLB (0.41) TP53PPARGPPARACYP1A2POLB
SCHEMBL10899765 0.73 L3MBTL1 (0.47) TP53PPARGPPARACYP1A2CYP3A4
SCHEMBL560907 0.73 PPARG (0.45) TP53PPARGPPARACYP1A2CYP3A4
SCHEMBL9355886 0.72 SLC6A2 (0.45) PPARGPPARACYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111989382-B Photochromic compound, curable composition containing the same, and optical article 株式会社德山 2024-01-05 CN disclosed
CN-112424260-B Photochromic compound and curable composition containing the same 株式会社德山 2023-10-13 CN disclosed
CN-116868095-A Resin composition, optical laminate, optical article, lens, and glasses 株式会社德山 2023-10-10 CN disclosed
CN-116806229-A Novel curable composition containing cyclic monomer 株式会社德山 2023-09-26 CN disclosed
CN-116745333-A Novel minute hollow particles formed of melamine resin 国立大学法人鹿儿岛大学 2023-09-12 CN disclosed
WO-2023167294-A1 METHOD FOR PRODUCING HOLLOW MICROPARTICLES USING SUPERCRITICAL LIQUID 株式会社トクヤマ 2023-09-07 WO disclosed
CN-112105676-B Low water content polyrotaxane monomer and curable composition containing the same 株式会社德山 2023-08-29 CN disclosed
CN-116096774-A Curable composition and cured product thereof 株式会社德山 2023-05-09 CN disclosed
CN-115916463-A Microspheres containing polymerizable functional groups 株式会社德山 2023-04-04 CN disclosed
CN-115768746-A Compound for optical material, curable composition, cured product, and optical article 株式会社德山 2023-03-07 CN disclosed
CN-111954832-A Photochromic optical article and method of making same 株式会社德山 2020-11-17 CN disclosed
WO-2020204176-A1 PHOTOCHROMIC OPTICAL ARTICLE AND METHOD FOR MANUFACTURING SAME 株式会社トクヤマ 2020-10-08 WO disclosed
CN-107207851-B Method for producing photochromic cured product 株式会社德山 2020-07-17 CN disclosed
CN-111154056-A Optical composition containing polyrotaxane 株式会社德山 2020-05-15 CN disclosed
CN-110869355-A Benzopyran compound, curable composition containing benzopyran compound, and optical article containing cured product formed from curable composition 株式会社德山 2020-03-06 CN disclosed
CN-110799573-A Photochromic polyrotaxane compound, and curable composition comprising same 株式会社德山 2020-02-14 CN disclosed
WO-2020032056-A1 CURABLE COMPOSITION CONTAINING POLYPSEUDOROTAXANE MONOMER 株式会社トクヤマ 2020-02-13 WO disclosed
WO-2019203205-A1 PHOTOCHROMIC COMPOUND, CURABLE COMPOSITION CONTAINING SAID PHOTOCHROMIC COMPOUND, AND OPTICAL ARTICLE 株式会社トクヤマ 2019-10-24 WO disclosed
WO-2019198675-A1 URETHANE RESIN USING POLYROTAXANE, AND PAD FOR POLISHING 株式会社トクヤマ 2019-10-17 WO disclosed
WO-2019198664-A1 PHOTOCHROMIC OPTICAL ARTICLE AND METHOD FOR MANUFACTURING SAME 株式会社トクヤマ 2019-10-17 WO disclosed