SCHEMBL6793261

SCHEMBL6793261

Cc1cccc(C)c1Nc1nccc(-c2c(-c3ccc(F)cc3)ncn2-c2ccc(F)cc2)n1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.48
BRD4 O60885 2/20 0.47
BRDT Q58F21 2/20 0.47
BRD2 P25440 1/20 0.47
BRD3 Q15059 1/20 0.47
MAPK13 O15264 5/20 0.46
MAPK12 P53778 5/20 0.46
MAPK11 Q15759 5/20 0.46
GSK3B P49841 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
SCHEMBL6795873 0.89 MAPK14 (0.49) MAPK14BRD4BRDTBRD2BRD3
SCHEMBL6791206 0.85 MAPK14 (0.57) MAPK14BRD4BRDTBRD2BRD3
SCHEMBL6798108 0.84 MAPK14 (0.54) MAPK14BRD4BRDTBRD2BRD3
SCHEMBL6793163 0.84 MAPK14 (0.64) MAPK14BRD4BRDTBRD2BRD3
SCHEMBL6785832 0.79 MAPK14 (0.76) MAPK14BRD4BRDTBRD2BRD3
SCHEMBL6794598 0.76 KCNH2 (0.61)
SCHEMBL7478606 0.74 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11GSK3B
SCHEMBL6578659 0.71 BRD4 (0.78) MAPK14BRD4BRDTBRD2BRD3
SCHEMBL6792523 0.70 MAPK14 (0.52) MAPK14BRD4BRDTBRD2BRD3
SCHEMBL6790550 0.69 MAPK14 (0.64) MAPK14BRD4BRDTBRD2BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730683-B2 Compounds of heteroaryl substituted imidazole, their pharmaceutical compositions and uses SMITHKLINE BEECHAM CORPORATION 2004-05-04 US claimed
US-20020198206-A1 Compounds of heteroaryl substituted imidazole, their pharmaceutical compositions and uses SMITHKLINE BEECHAM CORPORATION 2002-12-26 US claimed
US-6730683-B2 Compounds of heteroaryl substituted imidazole, their pharmaceutical compositions and uses SMITHKLINE BEECHAM CORPORATION 2004-05-04 US disclosed
US-20020198206-A1 Compounds of heteroaryl substituted imidazole, their pharmaceutical compositions and uses SMITHKLINE BEECHAM CORPORATION 2002-12-26 US disclosed
EP-1037639-A4 COMPOUNDS OF HETEROARYL SUBSTITUTED IMIDAZOLE, THEIR PHARMACEUTICAL COMPOSITIONS AND USES SMITHKLINE BEECHAM CORP (US) 2002-04-17 EP disclosed
US-6335340-B1 REACTING POLYMER BOUND 2-THIOPYRIMIDINE-4-YL IMINE WITH AN ISONITRILE; OXIDATION TO SULFONE OR SULFOXIDE TO RELEASE; AMINATION; ADMINISTERING AS CYTOKINE, INTERLEUKIN, AND TUMOR NECROSIS INHIBITORS SMITHKLINE BEECHAM CORPORATION 2002-01-01 US disclosed
EP-1037639-A1 COMPOUNDS OF HETEROARYL SUBSTITUTED IMIDAZOLE, THEIR PHARMACEUTICAL COMPOSITIONS AND USES SMITHKLINE BEECHAM CORPORATION (US) 2000-09-27 EP disclosed
WO-1999032121-A1 COMPOUNDS OF HETEROARYL SUBSTITUTED IMIDAZOLE, THEIR PHARMACEUTICAL COMPOSITIONS AND USES SMITHKLINE BEECHAM CORPORATION (US) 1999-07-01 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-20020198206-A1 Compounds of heteroaryl substituted imidazole, their pharmaceutical compositions and uses IL2, IFNG, IL2RA MAPK14 1513/4885BRD4 76/4885BRDT 292/4885

“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.