SCHEMBL5116871

SCHEMBL5116871

Cc1nnc(-c2ccc(-c3cc(C(=O)Nc4nncs4)ccc3C)cc2)o1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.65
MAP2K1 Q02750 2/20 0.53
MAPK11 Q15759 1/20 0.52
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LCK P06239 1/20 0.48
CSF1R P07333 1/20 0.48
KDR P35968 1/20 0.48
KDM4E B2RXH2 1/20 0.47
ADCY1 Q08828 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
SCHEMBL5117599 0.92 MAPK14 (0.64) MAPK14MAP2K1MAPK11ALDH1A1SMN1; SMN2
SCHEMBL5114250 0.84 MAPK14 (0.64) MAPK14MAP2K1MAPK11ALDH1A1SMN1; SMN2
SCHEMBL5898946 0.84 MAPK14 (0.60) MAPK14ALDH1A1SMN1; SMN2HSD17B10KDM4E
SCHEMBL5220199 0.83 MAPK14 (0.50) MAPK14MAP2K1MAPK11SMN1; SMN2
SCHEMBL5122607 0.77 MAPK14 (0.60) MAPK14MAP2K1MAPK11
SCHEMBL5124039 0.77 MAPK14 (0.63) MAPK14MAP2K1MAPK11ALDH1A1SMN1; SMN2
SCHEMBL3072596 0.76 MAPK14 (0.82) MAPK14MAP2K1MAPK11LCKCSF1R
SCHEMBL14078304 0.75 MAPK14 (0.71) MAPK14MAP2K1MAPK11ALDH1A1HSD17B10
SCHEMBL5216080 0.74 MAPK14 (0.88) MAPK14MAP2K1MAPK11
SCHEMBL4855098 0.74 MAPK14 (0.77) MAPK14MAP2K1MAPK11ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7425555-B2 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-09-16 US disclosed
US-7425555-B2 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-09-16 US disclosed
US-7425555-B2 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-09-16 US disclosed
EP-1499600-B1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2007-07-25 EP disclosed
US-20060089393-A1 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors GLAXOSMITHKLINE LLC 2006-04-27 US disclosed
EP-1499600-A1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2005-01-26 EP disclosed
WO-2003093248-A1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-11-13 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 (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-20060089393-A1 Heteroaryl substituted biphenyl derivatives as p38 kinase inhibitors MAPK1, MAPK7, MAP3K1 MAPK14 8/4885MAP2K1 67/4885MAPK11 36/4885

“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.