SCHEMBL4220189

SCHEMBL4220189

Cc1c(F)cc(C(=O)NC2CC2)cc1-c1ccc2c(cnn2-c2ccc(NCC3CCCO3)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.60
CYP2C9 P11712 4/20 0.60
RIPK2 O43353 3/20 0.52
HPGDS O60760 1/20 0.44
MAPK13 O15264 3/20 0.43
TTK P33981 1/20 0.42
ABL1 P00519 1/20 0.42

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
SCHEMBL4231176 0.88 MAPK14 (0.51) MAPK14CYP2C9RIPK2HPGDSMAPK13
SCHEMBL4215067 0.86 MAPK14 (0.57) MAPK14CYP2C9RIPK2HPGDSMAPK13
SCHEMBL4224227 0.85 MAPK14 (0.47) MAPK14CYP2C9HPGDSMAPK13
SCHEMBL4224605 0.84 MAPK14 (0.49) MAPK14CYP2C9HPGDSMAPK13
SCHEMBL4225219 0.84 HPGDS (0.53) MAPK14CYP2C9HPGDSMAPK13
SCHEMBL4221634 0.84 MAPK13 (0.51) MAPK14CYP2C9RIPK2HPGDSMAPK13
SCHEMBL3523606 0.83 MAPK14 (0.62) MAPK14CYP2C9MAPK13ABL1
SCHEMBL4220449 0.83 MAPK14 (0.49) MAPK14CYP2C9HPGDSMAPK13ABL1
SCHEMBL4221472 0.83 MAPK13 (0.51) MAPK14CYP2C9RIPK2HPGDSMAPK13
SCHEMBL4219621 0.82 MAPK14 (0.51) MAPK14CYP2C9HPGDSMAPK13ABL1

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-20090023725-A1 Fused Heteroaryl Derivatives for Use as P38 Kinase Inhibitors SMITHKLINE BEECHAM CORPORATION 2009-01-22 US claimed
EP-1708996-B1 FUSED HETEROYRAL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2008-08-27 EP claimed
US-20090023725-A1 Fused Heteroaryl Derivatives for Use as P38 Kinase Inhibitors SMITHKLINE BEECHAM CORPORATION 2009-01-22 US disclosed
US-20090023725-A1 Fused Heteroaryl Derivatives for Use as P38 Kinase Inhibitors SMITHKLINE BEECHAM CORPORATION 2009-01-22 US disclosed
US-20090023725-A1 Fused Heteroaryl Derivatives for Use as P38 Kinase Inhibitors SMITHKLINE BEECHAM CORPORATION 2009-01-22 US disclosed
EP-1708996-B1 FUSED HETEROYRAL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2008-08-27 EP 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-20090023725-A1 Fused Heteroaryl Derivatives for Use as P38 Kinase Inhibitors MAPK1, MAPKAPK2, MAPK7 MAPK14 19/4885CYP2C9 3757/4885RIPK2 458/4885

“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.