SCHEMBL5118066

SCHEMBL5118066

Cc1nc(-c2ccc(-c3cc(NC(=O)c4ccnc(N5CCCC5)c4)ccc3C)cc2)no1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 1.00
LCK P06239 2/20 0.65
MAP2K1 Q02750 2/20 0.65
RAF1 P04049 4/20 0.64
HSPB1 P04792 2/20 0.64
LYN P07948 1/20 0.64
CSF1R P07333 1/20 0.61
MAPK13 O15264 1/20 0.58
MAPK12 P53778 1/20 0.58
MAPK11 Q15759 1/20 0.58
BRAF P15056 3/20 0.57

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
SCHEMBL4700699 0.85 MAPK14 (0.74) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL3521625 0.82 MAPK14 (1.00) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL3529871 0.82 MAPK14 (0.87) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL4819509 0.81 MAPK14 (0.77) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL5376468 0.81 MAPK14 (0.71) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL4700681 0.81 MAPK14 (0.69) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL5117580 0.81 MAPK14 (1.00) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL4704090 0.80 MAPK14 (0.68) MAPK14LCKMAP2K1RAF1HSPB1
SCHEMBL14463260 0.80 MAPK14 (0.85) MAPK14LCKMAP2K1RAF1CSF1R
SCHEMBL13546241 0.79 MAPK14 (0.64) MAPK14LCKMAP2K1RAF1HSPB1

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 5 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

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 8/4885LCK 141/4885MAP2K1 67/4885

“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.