SCHEMBL539847

SCHEMBL539847

Cc1ccc2oc(=S)[nH]c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 7/20 0.72
KEAP1 Q14145 1/20 0.72
NOS1 P29475 2/20 0.61
NOS3 P29474 1/20 0.61
NOS2 P35228 1/20 0.61
KDM4E B2RXH2 2/20 0.56
GAA P10253 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPT P10636 1/20 0.56
ALDH1A1 P00352 3/20 0.53
RXFP1 Q9HBX9 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL31389041 1.00 PSMB8 (0.72) PSMB8KEAP1NOS1NOS3NOS2
SCHEMBL31389040 0.84 PSMB8 (1.00) PSMB8KEAP1NOS1NOS3NOS2
SCHEMBL799525 0.84 PSMB8 (1.00) PSMB8KEAP1NOS1NOS3NOS2
SCHEMBL12716526 0.79 KDM4E (0.82) PSMB8KEAP1NOS1NOS3NOS2
SCHEMBL10897160 0.78 PSMB8 (0.63) PSMB8KEAP1KDM4EGAAMEN1
SCHEMBL4704344 0.76 PSMB8 (0.61) PSMB8KEAP1NOS1NOS3NOS2
SCHEMBL780268 0.76 PSMB8 (0.61) PSMB8KEAP1KDM4EGAAMEN1
SCHEMBL777690 0.76 PSMB8 (1.00) PSMB8KEAP1NOS1NOS3NOS2
SCHEMBL243203 0.76 NOS1 (1.00) PSMB8KEAP1NOS1NOS3NOS2
SCHEMBL14403384 0.76 PSMB8 (0.72) PSMB8KEAP1KDM4EGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312878-A1 RUBBER COMPOSITION AND CROSSLINKED RUBBER MOLDED PRODUCT SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2023-10-05 US disclosed
US-20230312878-A1 RUBBER COMPOSITION AND CROSSLINKED RUBBER MOLDED PRODUCT SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2023-10-05 US disclosed
US-9249102-B2 Anthelmintic compounds and compositions and method of using thereof MERIAL, INC. (US) 2016-02-02 US disclosed
US-20140142114-A1 ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF MERIAL LIMITED (US) 2014-05-22 US disclosed
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-16 US disclosed
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-09 US disclosed
US-8501713-B2 Drug combinations for the treatment of duchenne muscular dystrophy SUMMIT CORPORATION PLC (GB) 2013-08-06 US disclosed
US-8273770-B2 5-pyridinone substituted indazoles ALBANY MOLECULAR RESEARCH, INC. (US) 2012-09-25 US disclosed
EP-2176251-B1 5-pyridinone substituted indazoles and pharmaceutical compositions thereof ALBANY MOLECULAR RES INC (US) 2012-02-08 EP disclosed
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy SUMMIT (OXFORD) LIMITED (GB) 2011-08-11 US disclosed
US-20050090504-A1 Piperidinyl and piperazinyl compounds substituted with bicyclo-heterocyclylalkyl groups useful as CCR3 receptor antagonists ROCHE PALO ALTO LLC 2005-04-28 US disclosed
EP-1480959-A1 PIPERAZINE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS GLAXO GROUP LIMITED (GB) 2004-12-01 EP disclosed
EP-1465638-A2 PHOSPHATE TRANSPORT INHIBITORS GENZYME CORPORATION (US) 2004-10-13 EP disclosed
US-20040019113-A1 Phosphate transport inhibitors GELTEX PHARMACEUTICALS, INC. 2004-01-29 US disclosed
WO-2003068759-A1 PIPERAZINE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS GLAXO GROUP LIMITED (GB) 2003-08-21 WO disclosed
WO-2003057225-A2 PHOSPHATE TRANSPORT INHIBITORS GENZYME CORPORATION (US) 2003-07-17 WO disclosed
US-4447522-A INCLUDING A HYDRAZIDE AND A MERCAPTO AMINE IN THE SILVER HALIDE EMULSION LAYER; LITHOGRAPHY FUJI PHOTO FILM CO., LTD. (JP) 1984-05-08 US disclosed
US-4429036-A DEVELOPMENT WITH ALKALINE AQUEOUS ACTIVATOR SOLUTION FUJI PHOTO FILM CO., LTD. (JP) 1984-01-31 US disclosed
US-4216284-A NONDIFFUSIBLE SILVER BLEACH INHIBITOR FUJI PHOTO FILM CO., LTD. (JP) 1980-08-05 US disclosed
US-4001020-A DEVELOPING A SILVER HA1IDE EMULSION IN CONTACT WITH A HETEROCYCLIC THIONE AND A POLYALKYLENE OXIDE FUJI PHOTO FILM CO., LTD. (JA) 1977-01-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040019113-A1 Phosphate transport inhibitors SLC34A1, SLC34A2, SLC20A1 PSMB8 2715/4885KEAP1 3372/4885NOS1 4266/4885
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy PYGM, CPT1B, GYS1 PSMB8 564/4885KEAP1 2233/4885NOS1 3432/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 PSMB8 564/4885KEAP1 2233/4885NOS1 3432/4885
US-20140142114-A1 ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF CYP3A5, ABCC5, CXXC5 PSMB8 1206/4885KEAP1 633/4885NOS1 4409/4885
US-20050090504-A1 Piperidinyl and piperazinyl compounds substituted with bicyclo-heterocyclylalkyl groups useful as CCR3 receptor antagonists CCR9, CCR3, CCR1 PSMB8 846/4885KEAP1 1608/4885NOS1 3831/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 PSMB8 952/4885KEAP1 3037/4885NOS1 744/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.