SCHEMBL2214287

SCHEMBL2214287

Cc1ccc(C(=O)NC2CC2)cc1-c1cc2cnn(-c3ccccc3)c2c[n+]1[O-]

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KHK P50053 4/20 0.54
MAPK14 Q16539 9/20 0.53
MAPK11 Q15759 2/20 0.51
LCK P06239 3/20 0.51
KIT P10721 3/20 0.51
KDR P35968 3/20 0.51
MAPKAPK2 P49137 2/20 0.49
MAPK13 O15264 1/20 0.49
RAF1 P04049 1/20 0.49
PDGFRA P16234 1/20 0.49
MAPK12 P53778 1/20 0.49
KCNH2 Q12809 1/20 0.49
RIPK2 O43353 6/20 0.48
HPGDS O60760 1/20 0.47

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
SCHEMBL2217584 0.88 MAPK14 (0.64) MAPK14MAPK11LCKKITKDR
SCHEMBL2216662 0.82 KHK (0.57) KHKMAPK14MAPK11LCKKIT
SCHEMBL2216631 0.81 MAPK14 (0.54) KHKMAPK14MAPK11MAPKAPK2MAPK13
SCHEMBL5567280 0.78 KHK (0.55) KHKMAPK14MAPK11LCKKIT
SCHEMBL4229997 0.74 NR3C1 (0.58) MAPK14MAPK11LCKKITKDR
SCHEMBL4219336 0.71 HPGDS (0.55) KHKMAPK14MAPK13HPGDS
SCHEMBL2214290 0.71 MAPK14 (0.54) KHKMAPK14MAPK11LCKKIT
SCHEMBL3523058 0.71 MAPK14 (0.56) MAPK14LCKKITKDRMAPK13
SCHEMBL4219489 0.71 NR3C1 (0.56) MAPK14MAPK11LCKKITKDR
SCHEMBL3520197 0.70 MAPK14 (0.60) MAPK14LCKKITKDRRIPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1709046-B1 P38 KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-07-27 EP disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 US disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 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 (1 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-20070161673-A1 P38 kinase inhibitors MAPK1, MAPK7, MAP3K1 KHK 2805/4885MAPK14 14/4885MAPK11 38/4885

“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.