SCHEMBL3093483

SCHEMBL3093483

COc1ccc(CNC(=O)c2ccc(-c3cc(C(=O)NC4CC4)ccc3C)nc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.68
CYP2C9 P11712 5/20 0.68
RIPK2 O43353 3/20 0.55
MAPK11 Q15759 4/20 0.52
BUB1 O43683 1/20 0.51
PRKACG P22612 1/20 0.51
MAPKAPK2 P49137 1/20 0.51
ACSL5 Q9ULC5 1/20 0.51
STK24 Q9Y6E0 1/20 0.51
PDE4A P27815 2/20 0.50
PDE4B Q07343 2/20 0.50
PDE4C Q08493 2/20 0.50
PDE4D Q08499 2/20 0.50
KDM1A O60341 1/20 0.50
HDAC1 Q13547 1/20 0.50
ROCK2 O75116 2/20 0.49
ROCK1 Q13464 1/20 0.48
HSPB1 P04792 1/20 0.48

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
SCHEMBL3407266 0.90 MAPK14 (0.76) MAPK14CYP2C9RIPK2MAPK11BUB1
SCHEMBL3408888 0.86 MAPK14 (0.73) MAPK14CYP2C9RIPK2MAPK11
SCHEMBL3214062 0.81 MAPK14 (0.54) MAPK14CYP2C9RIPK2MAPK11PDE4A
SCHEMBL3405481 0.81 MAPK14 (1.00) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3093442 0.81 MAPK14 (0.77) MAPK14CYP2C9RIPK2MAPK11BUB1
SCHEMBL3079711 0.81 MAPK14 (0.70) MAPK14CYP2C9RIPK2MAPK11BUB1
SCHEMBL14326940 0.80 MAPK14 (0.74) MAPK14CYP2C9RIPK2MAPK11BUB1
SCHEMBL3409344 0.79 MAPK14 (0.65) MAPK14CYP2C9MAPK11ROCK2ROCK1
SCHEMBL3408812 0.79 MAPK14 (0.77) MAPK14CYP2C9RIPK2MAPK11BUB1
SCHEMBL4003547 0.78 HDAC1 (0.54) MAPK14CYP2C9RIPK2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2251333-A1 Biphenyl derivatives as P-38 kinase inhibitors Novartis AG (CH) 2010-11-17 EP claimed
US-20100234404-A1 P-38 Kinase Inhibitors LANG HENGYUAN 2010-09-16 US claimed
US-20070111999-A1 P-38 kinase inhibitors TRIAD THERAPEUTICS, INC (US) 2007-05-17 US claimed
EP-1687284-A2 p-38 KINASE INHIBITORS Novartis AG (CH) 2006-08-09 EP claimed
WO-2005012241-A2 p-38 KINASE INHIBITORS NOVARTIS AG (CH) 2005-02-10 WO claimed
US-20050020590-A1 P-38 kinase inhibitors NOVARTIS AG (CH) 2005-01-27 US claimed
EP-2251333-A1 Biphenyl derivatives as P-38 kinase inhibitors Novartis AG (CH) 2010-11-17 EP disclosed
EP-1990338-B1 Biphenylcyclopropylamides as p-38 Kinase inhibitors NOVARTIS AG (CH) 2010-09-22 EP disclosed
US-20100234404-A1 P-38 Kinase Inhibitors LANG HENGYUAN 2010-09-16 US disclosed
US-20100234404-A1 P-38 Kinase Inhibitors LANG HENGYUAN 2010-09-16 US disclosed
US-20100234404-A1 P-38 Kinase Inhibitors LANG HENGYUAN 2010-09-16 US disclosed
US-7754726-B2 Benzamide derivatives as p-38 kinase inhibitors NOVARTIS AG (CH) 2010-07-13 US disclosed
US-7754726-B2 Benzamide derivatives as p-38 kinase inhibitors NOVARTIS AG (CH) 2010-07-13 US disclosed
EP-1687284-B1 p-38 KINASE INHIBITORS NOVARTIS AG (CH) 2008-10-29 EP disclosed
US-20070111999-A1 P-38 kinase inhibitors TRIAD THERAPEUTICS, INC (US) 2007-05-17 US disclosed
US-20070111999-A1 P-38 kinase inhibitors TRIAD THERAPEUTICS, INC (US) 2007-05-17 US disclosed
US-20070111999-A1 P-38 kinase inhibitors TRIAD THERAPEUTICS, INC (US) 2007-05-17 US disclosed
EP-1687284-A2 p-38 KINASE INHIBITORS Novartis AG (CH) 2006-08-09 EP disclosed
WO-2005012241-A2 p-38 KINASE INHIBITORS NOVARTIS AG (CH) 2005-02-10 WO disclosed
US-20050020590-A1 P-38 kinase inhibitors NOVARTIS AG (CH) 2005-01-27 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 (3 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-20070111999-A1 P-38 kinase inhibitors MAPK8, MAP3K8, MAPK1 MAPK14 52/4885CYP2C9 4795/4885RIPK2 489/4885
US-20050020590-A1 P-38 kinase inhibitors MAPK8, MAP3K8, MAPK1 MAPK14 55/4885CYP2C9 4809/4885RIPK2 490/4885
US-20100234404-A1 P-38 Kinase Inhibitors MAPK8, MAP3K8, MAPK1 MAPK14 52/4885CYP2C9 4795/4885RIPK2 489/4885

“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.