SCHEMBL4383142

SCHEMBL4383142

Cc1cc(O)cc(=O)n1-c1ccc2[nH]ncc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.45
CYP3A4 P08684 3/20 0.43
ROCK1 Q13464 4/20 0.43
JAK2 O60674 3/20 0.43
GSK3B P49841 3/20 0.43
PIM1 P11309 2/20 0.43
CHEK1 O14757 1/20 0.43
AURKA O14965 1/20 0.43
DAPK3 O43293 1/20 0.43
PRKD3 O94806 1/20 0.43
MAP4K4 O95819 1/20 0.43
PAK4 O96013 1/20 0.43
NTRK1 P04629 1/20 0.43
FYN P06241 1/20 0.43
CSF1R P07333 1/20 0.43
RET P07949 1/20 0.43
MET P08581 1/20 0.43
PDGFRB P09619 1/20 0.43
FGFR1 P11362 1/20 0.43
PDGFRA P16234 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
SCHEMBL4387311 0.90 FGFR1 (0.44) CYP3A4FGFR1DYRK1APTGER1MAP3K11
SCHEMBL4462803 0.80 ROCK2 (0.46) MAT2AROCK1JAK2GSK3BPIM1
SCHEMBL20110718 0.72 MAPKAPK2 (0.41) MAT2ACYP3A4ROCK1JAK2GSK3B
SCHEMBL3526642 0.72 ROCK2 (0.49) ROCK1ALKROCK2
SCHEMBL12680064 0.71 MAPKAPK2 (0.52) MAT2ACYP3A4ROCK1JAK2GSK3B
SCHEMBL4566556 0.68 MAPKAPK2 (0.51) MAT2ACYP3A4ROCK1JAK2GSK3B
SCHEMBL277777 0.68 ROCK2 (0.59) ROCK1JAK2GSK3BPIM1CHEK1
SCHEMBL29520931 0.68 ROCK2 (0.59) ROCK1JAK2GSK3BPIM1CHEK1
SCHEMBL18188562 0.68 JAK2 (0.42) MAT2ACYP3A4ROCK1JAK2GSK3B
SCHEMBL23549025 0.67 MAT2A (0.69) MAT2ACYP3A4ROCK1PRKD3MAP4K4

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-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
US-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
US-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
EP-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP disclosed
US-7067540-B2 Substituted pyridinones PHARMACIA CORPORATION (US) 2006-06-27 US disclosed
US-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 US disclosed
WO-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed
EP-1490064-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE Pharmacia Corporation (US) 2004-12-29 EP disclosed
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 US disclosed
WO-2003068230-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORPORATION (US) 2003-08-21 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-20040058964-A1 Substituted pyridinones MAPK1, MAPK6, MAPK7 MAT2A 2576/4885CYP3A4 1085/4885ROCK1 332/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAT2A 2414/4885CYP3A4 710/4885ROCK1 603/4885

“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.