SCHEMBL28895315

SCHEMBL28895315

O=C(CSCC(=O)OCC(S)CS)OCC(S)CS

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.35
NR1I2 O75469 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL23152032 0.88 NR1I2 (0.32) SLC22A6NR1I2ALDH1A1LMNACYP1A2
SCHEMBL5068252 0.80 HSD17B10 (0.39) SLC22A6NR1I2ALDH1A1LMNACYP1A2
SCHEMBL21835883 0.80 LMNA (0.36) SLC22A6NR1I2ALDH1A1LMNACYP1A2
SCHEMBL330897 0.80 HSD17B10 (0.39) SLC22A6NR1I2ALDH1A1LMNACYP1A2
SCHEMBL332035 0.80 LMNA (0.33) NR1I2ALDH1A1LMNACYP1A2HTT
SCHEMBL28597998 0.77 MAPT (0.35) ALDH1A1LMNATDP1
SCHEMBL31065801 0.77
SCHEMBL22721833 0.77 ALDH1A1 (0.42) SLC22A6NR1I2ALDH1A1LMNACYP1A2
SCHEMBL331859 0.77 LMNA (0.33) SLC22A6NR1I2ALDH1A1LMNACYP1A2
SCHEMBL330833 0.76 TSHR (0.34) NR1I2ALDH1A1LMNACYP1A2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118745246-A High refractive material based on biomass magnolol and honokiol 中国科学院上海有机化学研究所 2024-10-08 CN claimed
CN-118745246-A High refractive material based on biomass magnolol and honokiol 中国科学院上海有机化学研究所 2024-10-08 CN disclosed
CN-117327362-A Curable resin composition 东京应化工业株式会社 2024-01-02 CN disclosed
WO-2022188825-A1 XYLYLENE DIISOCYNATE COMPOSITION, PREPARATION METHOD THEREFOR AND USE THEREOF 万华化学集团股份有限公司 2022-09-15 WO disclosed
CN-114891336-A Transparent plastic substrate and plastic lens 豪雅镜片泰国有限公司 2022-08-12 CN disclosed
CN-114891337-A Transparent plastic substrate and plastic lens 豪雅镜片泰国有限公司 2022-08-12 CN disclosed
CN-110799573-B Photochromic polyrotaxane compound, and curable composition comprising same 株式会社德山 2022-06-03 CN disclosed
CN-114525027-A Transparent plastic base material and plastic lens 豪雅镜片泰国有限公司 2022-05-24 CN disclosed
CN-109070505-B Ophthalmic lens and method for producing an ophthalmic lens 卡尔蔡司光学国际有限公司 2020-07-10 CN disclosed