SCHEMBL9109600

SCHEMBL9109600

Cc1cccc(COc2cc(C)n(-c3ccnc(-c4nc(C(C)C)ncc4C)c3)c(=O)c2C)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.35
MAOB P27338 3/20 0.35
MAOA P21397 1/20 0.35
MRGPRX4 Q96LA9 3/20 0.32
FFAR4 Q5NUL3 1/20 0.32
SGMS2 Q8NHU3 1/20 0.32
MAPKAPK2 P49137 3/20 0.32
MAPKAPK5 Q8IW41 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PTGER1 P34995 1/20 0.31

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
SCHEMBL9110474 0.92 MAPKAPK2 (0.39) MAPK14MAOBMAOAMRGPRX4FFAR4
SCHEMBL9110080 0.92 MAPK14 (0.46) MAPK14MAOBMAOA
SCHEMBL9111368 0.91 PTGER1 (0.37) MAPK14MAOBMAOAALDH1A1PTGER1
SCHEMBL9112100 0.91 MAPK14 (0.37) MAPK14MAOBMAOAMRGPRX4FFAR4
SCHEMBL9109540 0.89 MAPKAPK2 (0.38) MAPK14MAOBMAOAFFAR4MAPKAPK2
SCHEMBL9112232 0.88 MAPKAPK2 (0.41) MAPK14MAOBMAOAMRGPRX4FFAR4
SCHEMBL9112089 0.87 MAPK14 (0.50) MAPK14MAPKAPK2MAPKAPK5PTGER1
SCHEMBL9109343 0.86 MAPK14 (0.32) MAPK14MAPKAPK2MAPKAPK5
SCHEMBL9901669 0.86 MAOB (0.35) MAOBMAOAALDH1A1
SCHEMBL9110968 0.86 MAPK14 (0.37) MAPK14MAOBMAOAMRGPRX4FFAR4

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
EP-3469907-B1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS ACLARIS THERAPEUTICS INC (US) 2021-03-03 EP claimed
EP-3469907-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS Aclaris Therapeutics, Inc. (US) 2019-04-17 EP claimed
US-9365546-B2 Substituted pyridinone-pyridinyl compounds CONFLUENCE LIFE SCIENCES INC. (US) 2016-06-14 US claimed
US-20140171449-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS CONFLUENCE LIFE SCIENCES INC. (US) 2014-06-19 US claimed
EP-2648516-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS Confluence Life Sciences, Inc. (US) 2013-10-16 EP claimed
WO-2012078684-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS CONFLUENCE LIFE SCIENCES, INC. (US) 2012-06-14 WO claimed
US-20120142709-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS ACLARIS THERAPEUTICS, INC. 2012-06-07 US claimed
EP-3469907-B1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS ACLARIS THERAPEUTICS INC (US) 2021-03-03 EP disclosed
EP-3469907-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS Aclaris Therapeutics, Inc. (US) 2019-04-17 EP disclosed
EP-2648516-B1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS ACLARIS THERAPEUTICS INC (US) 2018-09-05 EP disclosed
EP-2648516-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS Confluence Life Sciences, Inc. (US) 2013-10-16 EP disclosed
WO-2012078684-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS CONFLUENCE LIFE SCIENCES, INC. (US) 2012-06-14 WO 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 (2 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-20120142709-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS MAPK1, MAP3K1, MAP3K6 MAPK14 47/4885MAOB 750/4885MAOA 1574/4885
US-20140171449-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS MAPK1, MAP3K1, MAP3K6 MAPK14 47/4885MAOB 750/4885MAOA 1574/4885

“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.