SCHEMBL4219701

SCHEMBL4219701

Cc1ccc(=O)n(-c2cccs2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.53
KDM4E B2RXH2 2/20 0.53
HSD17B10 Q99714 2/20 0.53
CYP1A2 P05177 1/20 0.53
HPGD P15428 1/20 0.53
BLM P54132 1/20 0.53
POLB P06746 2/20 0.37
MAPT P10636 7/20 0.36
ALOX5 P09917 1/20 0.36
NPC1 O15118 5/20 0.36
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MAPK14 Q16539 1/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
GFER P55789 1/20 0.35
TYMP P19971 1/20 0.35

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
SCHEMBL3970272 0.72 ALDH1A1 (0.77) ALDH1A1KDM4EHSD17B10CYP1A2HPGD
SCHEMBL9471238 0.72 TSHR (0.46) ALDH1A1KDM4EHSD17B10HPGDPOLB
SCHEMBL710871 0.71 MAPK1 (0.43) HPGDSMN1; SMN2TYMPLMNA
SCHEMBL10025187 0.71 KDM4E (0.74) ALDH1A1KDM4EHSD17B10CYP1A2HPGD
SCHEMBL4283447 0.70 GRM1 (0.37) ALDH1A1KDM4EHSD17B10CYP1A2HPGD
SCHEMBL356681 0.70 ALDH1A1 (0.80) ALDH1A1KDM4EHSD17B10CYP1A2HPGD
Pirfenidone SCHEMBL4708 0.69 KDM4E (1.00) ALDH1A1KDM4EHSD17B10CYP1A2HPGD
Pirfenidone SCHEMBL1006039 0.69 KDM4E (1.00) ALDH1A1KDM4EHSD17B10CYP1A2HPGD
SCHEMBL25457541 0.68 MEN1 (0.35) CYP1A2POLBMAPTSMN1; SMN2GAA
Pirfenidone SCHEMBL22492268 0.68 KDM4E (0.96) ALDH1A1KDM4EHSD17B10CYP1A2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0866656-B1 USE OF N-SUBSTITUTED PYRIDONES AS TUMOR NECROSIS FACTOR ALPHA INHIBITORS MARGOLIN SOLOMON B (US) 2007-04-25 EP claimed
EP-1261338-B1 COMPOSITIONS AND METHODS FOR TREATMENT OF EPILEPSY CYMAR INC (US) 2006-06-14 EP claimed
EP-1069898-B1 TOPICAL ANTISEPTIC COMPOSITIONS AND METHODS MARGOLIN SOLOMON B (US) 2004-05-12 EP claimed
EP-0813409-B1 TREATMENT OF CYTOKINE GROWTH FACTOR CAUSED DISORDERS MARGOLIN SOLOMON B (US) 2004-05-06 EP claimed
US-5962478-A ADMINISTERING A N-SUBSTITUTED 2(1H)PYRIDONE INTERMUNE, INC. 1999-10-05 US claimed
US-12023342-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof AVALYN PHARMA INC. (US) 2024-07-02 US disclosed
US-20230149375-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF AVALYN PHARMA INC. 2023-05-18 US disclosed
US-11559520-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof AVALYN PHARMA INC. (US) 2023-01-24 US disclosed
US-20220218683-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF AVALYN PHARMA INC. 2022-07-14 US disclosed
US-11224592-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof AVALYN PHARMA INC. (US) 2022-01-18 US disclosed
US-20210346399-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF AVALYN PHARMA INC. (US) 2021-11-11 US disclosed
US-11071741-B2 Aerosol pirfenidone and pyridone analog compound and uses thereof AVALYN PHARMA INC. (US) 2021-07-27 US disclosed
US-20060198823-A1 Compositions and methods for treating viral infections INTERMUNE, INC. 2006-09-07 US disclosed
EP-1261338-B1 COMPOSITIONS AND METHODS FOR TREATMENT OF EPILEPSY CYMAR INC (US) 2006-06-14 EP disclosed
US-20050267018-A1 Macrocyclic compounds as inhibitors of viral replication HOFFMANN-LA ROCHE INC. 2005-12-01 US disclosed
US-6956044-B1 Compositions and methods for treatment of epilepsy INTERMUNE, INC. 2005-10-18 US disclosed
US-5962478-A ADMINISTERING A N-SUBSTITUTED 2(1H)PYRIDONE INTERMUNE, INC. 1999-10-05 US disclosed
US-4052509-A 5-METHYL-1-PHENYL-2-(1H)-PYRIDONE AFFILIATED MEDICAL RESEARCH, INC. (US) 1977-10-04 US disclosed
US-4042699-A 5-METHYL-1-PHENYL-2-(1H)-PYRIDONE AFFILIATED MEDICAL RESEARCH, INC. (US) 1977-08-16 US disclosed
US-3974281-A ANALGESICS, ANTI-PYRETIC AND ANTI-INFLAMMATORY AGENTS AFFILIATED MEDICAL RESEARCH, INC. (US) 1976-08-10 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 (9 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-20230149375-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF PLPBP, PIR, PDXK ALDH1A1 167/4885KDM4E 2879/4885HSD17B10 2978/4885
US-11224592-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof PLPBP, PIR, PDXK ALDH1A1 167/4885KDM4E 2879/4885HSD17B10 2978/4885
US-20060198823-A1 Compositions and methods for treating viral infections IFNAR1, IFNG, TLR3 ALDH1A1 3230/4885KDM4E 4064/4885HSD17B10 2588/4885
US-20220218683-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF PLPBP, PIR, PDXK ALDH1A1 167/4885KDM4E 2879/4885HSD17B10 2978/4885
US-11559520-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof PLPBP, PIR, PDXK ALDH1A1 167/4885KDM4E 2879/4885HSD17B10 2978/4885
US-20050267018-A1 Macrocyclic compounds as inhibitors of viral replication EIF2AK2, HAVCR2, ZC3HAV1 ALDH1A1 2109/4885KDM4E 616/4885HSD17B10 2478/4885
US-20210346399-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF PLPBP, PIR, PDXK ALDH1A1 167/4885KDM4E 2879/4885HSD17B10 2978/4885
US-12023342-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof PLPBP, PIR, PDXK ALDH1A1 167/4885KDM4E 2879/4885HSD17B10 2978/4885
US-11071741-B2 Aerosol pirfenidone and pyridone analog compound and uses thereof PLPBP, PIR, PDXK ALDH1A1 181/4885KDM4E 2831/4885HSD17B10 2972/4885

“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.