SCHEMBL9602182

SCHEMBL9602182

O=S(=O)(O)c1ccc2nc3ccccc3nc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.51
TDP1 Q9NUW8 2/20 0.49
NQO2 P16083 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TSHR P16473 2/20 0.46
SNCA P37840 1/20 0.46
MAPT P10636 5/20 0.44
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
NPC1 O15118 5/20 0.43
POLB P06746 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
USP2 O75604 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
RAB9A P51151 4/20 0.43
KDM4E B2RXH2 2/20 0.43
PABPC1 P11940 1/20 0.43
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 3/20 0.42

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
SCHEMBL21713276 0.94 HDAC6 (0.47) HDAC6TDP1SMN1; SMN2TSHRSNCA
SCHEMBL29593464 0.94 HDAC6 (0.47) HDAC6TDP1SMN1; SMN2TSHRSNCA
SCHEMBL29460076 0.86 ALDH1A1 (0.48) HDAC6TDP1TSHRSNCAKDM4E
SCHEMBL20584147 0.86 ALDH1A1 (0.48) HDAC6TDP1TSHRSNCAKDM4E
SCHEMBL21497950 0.85 LMNA (0.52) HDAC6TDP1TSHRSNCAKDM4E
SCHEMBL21497949 0.85 LMNA (0.52) HDAC6TDP1TSHRSNCAKDM4E
SCHEMBL30092607 0.85 LMNA (0.52) HDAC6TDP1TSHRSNCAKDM4E
SCHEMBL3267891 0.84 ALDH1A1 (0.46) HDAC6TDP1SMN1; SMN2TSHRSNCA
SCHEMBL13324843 0.83 ALDH1A1 (0.54) HDAC6TDP1SMN1; SMN2TSHRSNCA
SCHEMBL11390984 0.82 HDAC6 (0.43) HDAC6TDP1SMN1; SMN2TSHRSNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11603597-B2 Production of chemical products using electrochemical flow systems and mediators and associated methods MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-03-14 US disclosed
US-11236429-B2 Production of chemical products using electrochemical flow systems and slug flow and associated methods MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2022-02-01 US disclosed
CN-113166079-A Redox active compounds and their use 克姆布鲁项目公司 2021-07-23 CN disclosed
EP-3837246-A2 REDOX-ACTIVE COMPOUNDS AND USES THEREOF CMBlu Projekt AG (DE) 2021-06-23 EP disclosed
US-20200056291-A1 PRODUCTION OF CHEMICAL PRODUCTS USING ELECTROCHEMICAL FLOW SYSTEMS AND MEDIATORS AND ASSOCIATED METHODS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-02-20 US disclosed
WO-2020035548-A2 REDOX-ACTIVE COMPOUNDS AND USES THEREOF CMBLU PROJEKT AG (DE) 2020-02-20 WO disclosed
US-20200056298-A1 PRODUCTION OF CHEMICAL PRODUCTS USING ELECTROCHEMICAL FLOW SYSTEMS AND SLUG FLOW AND ASSOCIATED METHODS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-02-20 US disclosed
EP-0250676-B1 NON-ENZYMATIC IMMUNOHISTOCHEMICAL STAINING SYSTEM AND REAGENTS Immunomedics, Inc. (US) 1993-03-10 EP disclosed
US-4792521-A Non-enzymatic immunohistochemical staining system and reagents IMMUNOMEDICS, INC. (US) 1988-12-20 US disclosed
EP-0250676-A2 Non-enzymatic immunohistochemical staining system and reagents Immunomedics, Inc. (US) 1988-01-07 EP disclosed