SCHEMBL4022981

SCHEMBL4022981

Cc1c(C(=O)N(C)C)cc(C(=O)NCc2ccc3c(c2)CCO3)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
ELANE P08246 5/20 0.47
RAB9A P51151 2/20 0.45
CCR1 P32246 4/20 0.44
PPARG P37231 1/20 0.41
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
CHRM4 P08173 1/20 0.39
DDT P30046 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NOTUM Q6P988 1/20 0.38
AURKA O14965 1/20 0.38
RPS6KB1 P23443 1/20 0.38

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
SCHEMBL4019562 0.88 PPARG (0.53) MAPTELANECCR1PPARGPOLB
SCHEMBL4023318 0.86 ELANE (0.52) ELANECCR1DDTALDH1A1NOTUM
SCHEMBL4023320 0.86 ELANE (0.59) ELANECCR1DDTALDH1A1NOTUM
SCHEMBL5758430 0.86 ELANE (0.65) MAPTELANERAB9ACCR1PPARG
SCHEMBL4024041 0.85 CCR1 (0.54) MAPTELANECCR1DDTALDH1A1
SCHEMBL4021150 0.84 ELANE (0.53) ELANECCR1DDTALDH1A1NOTUM
SCHEMBL4021451 0.83 ELANE (0.56) ELANECCR1POLBDDTALDH1A1
SCHEMBL5443151 0.83 MAPT (0.56) MAPTELANERAB9ACCR1NPC1
SCHEMBL5755679 0.82 MAPT (0.56) MAPTELANERAB9ACCR1NPC1
SCHEMBL11894815 0.81 ELANE (0.54) ELANECCR1DDTALDH1A1NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11559520-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof AVALYN PHARMA INC. (US) 2023-01-24 US disclosed
US-20210069165-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF AVALYN PHARMA INC. (US) 2021-03-11 US disclosed
US-10092552-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof AVALYN PHARMA INC. (US) 2018-10-09 US disclosed
US-20170224706-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF GENOA PHARMACEUTICALS, INC. 2017-08-10 US disclosed
US-20120192861-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF GENOA PHARMACEUTICALS, INC. (US) 2012-08-02 US disclosed
EP-1663974-B1 2-PYRIDONE DERIVATIVES AS NETROPHIL ELASTASE INHIBITORS AND THEIR USE ASTRAZENECA AB (SE) 2009-01-14 EP disclosed
US-20070043036-A1 2-Pyridone derivatives as neutrophil elastase inhibitors and their use ASTRAZENECA AB (SE) 2007-02-22 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-20210069165-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF PLPBP, PIR, PDXK MAPT 1705/4885ELANE 1574/4885RAB9A 3999/4885
US-20070043036-A1 2-Pyridone derivatives as neutrophil elastase inhibitors and their use SERPINB1, ELANE, SERPINE1 MAPT 1663/4885ELANE 2/4885RAB9A 2021/4885
US-11559520-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof PLPBP, PIR, PDXK MAPT 1705/4885ELANE 1574/4885RAB9A 3999/4885
US-20120192861-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF PLPBP, PIR, PDXK MAPT 1705/4885ELANE 1574/4885RAB9A 3999/4885
US-20170224706-A1 AEROSOL PIRFENIDONE AND PYRIDONE ANALOG COMPOUNDS AND USES THEREOF PLPBP, PIR, PDXK MAPT 1705/4885ELANE 1574/4885RAB9A 3999/4885
US-10092552-B2 Aerosol pirfenidone and pyridone analog compounds and uses thereof PLPBP, PIR, PDXK MAPT 1705/4885ELANE 1574/4885RAB9A 3999/4885

“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.