SCHEMBL21409501

SCHEMBL21409501

CCCCCSCC1CS1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.36
GMNN O75496 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
CYP2C9 P11712 1/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CA2 P00918 1/20 0.35
TBXA2R P21731 2/20 0.33
PRKD3 O94806 2/20 0.33
PRKCG P05129 2/20 0.33
PRKCB P05771 2/20 0.33
PRKCA P17252 2/20 0.33
PRKCH P24723 2/20 0.33
PRKCI P41743 2/20 0.33
PRKCE Q02156 2/20 0.33
PRKCQ Q04759 2/20 0.33
PRKCZ Q05513 2/20 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
SCHEMBL10661851 0.98 CES2 (0.39) CES2GMNNTP53POLBMAPT
SCHEMBL2786229 0.98 CES2 (0.39) CES2GMNNTP53POLBMAPT
SCHEMBL2786912 0.93
SCHEMBL1402517 0.89
SCHEMBL6846310 0.87 TSHR (0.34)
SCHEMBL1402446 0.86
SCHEMBL1402546 0.86
SCHEMBL6847898 0.84
SCHEMBL1402638 0.84
SCHEMBL13636709 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111748069-B Optical resin composition and optical resin material prepared from same 万华化学集团股份有限公司 2022-04-22 CN claimed
CN-111748069-A Optical resin composition and optical resin material prepared from same 万华化学集团股份有限公司 2020-10-09 CN claimed
CN-116554434-A Diisocyanate composition for optical lenses and method for preparing the same SKC株式会社 2023-08-08 CN disclosed
CN-112920082-B Diisocyanate composition, method for preparing the same, and optical material using the same SKC株式会社 2023-06-23 CN disclosed
CN-112920374-B Diisocyanate composition for optical lenses and method for preparing the same SKC株式会社 2023-05-30 CN disclosed
CN-112920373-B Diisocyanate composition, method for preparing the same, and optical material using the same SKC株式会社 2023-05-12 CN disclosed
CN-112920375-B Method for preparing diisocyanate composition and optical lens SKC株式会社 2023-05-12 CN disclosed
CN-112920372-B Method for preparing diisocyanate composition and optical lens SKC株式会社 2023-05-12 CN disclosed
CN-112920371-B Process for preparing diisocyanate compositions SKC株式会社 2023-05-12 CN disclosed
CN-112920370-B Method for preparing diisocyanate composition and optical lens SKC株式会社 2023-05-12 CN disclosed
CN-113166311-B Composition for optical material and optical material 株式会社德山 2023-01-06 CN disclosed
WO-2020129933-A1 OPTICAL MATERIAL COMPOSITION AND OPTICAL MATERIAL 株式会社トクヤマ 2020-06-25 WO disclosed
CN-104903754-B Optical material, composition for optical material, and use thereof 三井化学株式会社 2020-05-22 CN disclosed
WO-2020040485-A1 STABILIZER FOR EPISULFIDE-BASED OPTICAL MATERIAL HAVING HIGH REFRACTIVE INDEX, COMPOSITION FOR OPTICAL MATERIAL USING SAME, AND METHOD FOR PRODUCING OPTICAL MATERIAL 주식회사 케이오씨솔루션 2020-02-27 WO disclosed
WO-2020022369-A1 METHOD FOR SETTING POLYMERIZATION CONDITIONS AND METHOD FOR PRODUCING OPTICAL MATERIAL 三井化学株式会社 2020-01-30 WO disclosed
WO-2019187176-A1 METHOD FOR SETTING POLYMERIZATION CONDITIONS AND METHOD FOR PRODUCING OPTICAL MATERIAL 三井化学株式会社 2019-10-03 WO disclosed
CN-105556351-A Optical material and use thereof MITSU CHEMICALS INC 2016-05-04 CN disclosed
CN-105518492-A Optical material and use therefor MITSU CHEMICALS INC 2016-04-20 CN disclosed
CN-104969092-A Optical material and use thereof MITSUI CHEMICALS INC 2015-10-07 CN disclosed
CN-104903754-A Optical material, composition for optical material, and use thereof MITSU CHEMICALS INC 2015-09-09 CN disclosed