SCHEMBL3526740

SCHEMBL3526740

Cc1ccc(C(=O)NC2CC2)cc1-c1ccc2c(cnn2S(=O)(=O)c2ccc(F)c(F)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.52
LCK P06239 5/20 0.52
KDR P35968 5/20 0.52
CSF1R P07333 1/20 0.52
KIT P10721 6/20 0.51
RIPK2 O43353 4/20 0.47
MAPK9 P45984 3/20 0.47
MAPK10 P53779 1/20 0.47
MAPK13 O15264 1/20 0.46
RAF1 P04049 1/20 0.46
PDGFRA P16234 1/20 0.46
MAPKAPK2 P49137 1/20 0.46
MAPK12 P53778 1/20 0.46
KCNH2 Q12809 1/20 0.46
MAPK11 Q15759 1/20 0.46

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
SCHEMBL3527666 0.92 MAPK14 (0.54) MAPK14LCKKDRCSF1RKIT
SCHEMBL3523217 0.90 MAPK14 (0.48) MAPK14MAPK13
SCHEMBL3524964 0.90 MAPK14 (0.55) MAPK14LCKKDRCSF1RKIT
SCHEMBL3521942 0.89 MAPK14 (0.51) MAPK14LCKKDRCSF1RKIT
SCHEMBL3521746 0.89 MAPK14 (0.55) MAPK14LCKKDRCSF1RKIT
SCHEMBL3523058 0.88 MAPK14 (0.56) MAPK14LCKKDRCSF1RKIT
SCHEMBL3524367 0.88 RIPK2 (0.53) MAPK14LCKKDRCSF1RKIT
SCHEMBL3523918 0.87 MAPK14 (0.51) MAPK14LCKKDRCSF1RKIT
SCHEMBL3523800 0.87 MAPK14 (0.57) MAPK14LCKKDRCSF1RKIT
SCHEMBL3520197 0.85 MAPK14 (0.60) MAPK14LCKKDRCSF1RKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis SMITHKLINE BEECHAM CORPORATION 2006-06-08 US claimed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
EP-1531812-B1 FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRITIS SMITHKLINE BEECHAM CORP (US) 2007-06-27 EP disclosed
US-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis SMITHKLINE BEECHAM CORPORATION 2006-06-08 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-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis MAPK7, CNKSR1, MAPK1 MAPK14 11/4885LCK 303/4885KDR 2864/4885

“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.