SCHEMBL6908020

SCHEMBL6908020

O=C1OC(=O)c2cc(SSc3ccc4c(c3)C(=O)OC4=O)ccc21

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 1/20 0.47
MAOA P21397 5/20 0.40
MAOB P27338 5/20 0.40
TYMS P04818 2/20 0.37
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA7 P43166 2/20 0.35
CA4 P22748 1/20 0.35
BCL2 P10415 1/20 0.34
MCL1 Q07820 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PTGS2 P35354 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 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
SCHEMBL29383846 0.86 MAOA (0.53) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL301318 0.86 MAOA (0.53) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL13298544 0.84 MAOA (0.56) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL92584 0.84 MAOA (0.56) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL84289 0.83 PTGS2 (0.47) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL84478 0.81 MAOA (0.53) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL19034747 0.81 MAOA (0.53) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL84479 0.79 MAOA (0.66) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL13970854 0.78 FTO (0.47) ALOX15TDP1ALDH1A1MAOAMAOB
SCHEMBL24946582 0.75 MAOA (0.47) ALOX15TDP1ALDH1A1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-221607817-U Extraction device for saccharin sodium wastewater detection 河南省科学院化学研究所有限公司 2024-08-27 CN disclosed
CN-115893593-B Resource utilization process for heavy metal-containing wastewater 浙江卓锦环保科技股份有限公司 2024-06-11 CN disclosed
CN-117169366-A Saccharin sodium impurity detection method and equipment 河北允升生物科技有限公司 2023-12-05 CN disclosed
CN-116559313-A Qualitative analysis method for organic components in saccharin sodium production wastewater 河南省科学院化学研究所有限公司 2023-08-08 CN disclosed
CN-115893593-A Resource utilization process for heavy metal-containing wastewater 浙江卓锦环保科技股份有限公司 2023-04-04 CN disclosed
CN-114057664-A Method for recovering 1, 1-dioxo-1, 2-benzisothiazol-3 (2H) -one sodium salt 河南莱伯瑞特科技有限公司 2022-02-18 CN disclosed
CN-213880364-U Saccharin sodium production antistatic unit 河北允升生物科技有限公司 2021-08-03 CN disclosed
CN-106865882-B Method for treating saccharin sodium production wastewater by phthalic anhydride method 中国科学院大连化学物理研究所 2020-11-27 CN disclosed
EP-0966493-A4 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMW SCIENT IND RES ORG (AU) 2004-04-21 EP disclosed
US-6344523-B1 POLYIMIDES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION OF CAMPBELL (AU) 2002-02-05 US disclosed
EP-0966493-A1 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1999-12-29 EP disclosed
WO-1998040422-A1 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1998-09-17 WO disclosed