SCHEMBL5792885

SCHEMBL5792885

Cc1cccc(-c2nc(NC(=O)c3cccnc3C)sc2-c2ccnc(NCc3ccccc3)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.63
IKBKB O14920 1/20 0.55
MAPK13 O15264 1/20 0.55
PRKD3 O94806 1/20 0.55
MAP4K4 O95819 1/20 0.55
EGFR P00533 1/20 0.55
MAPK1 P28482 1/20 0.55
FLT4 P35916 1/20 0.55
KDR P35968 1/20 0.55
FRK P42685 1/20 0.55
MAPK8 P45983 1/20 0.55
MAPK9 P45984 1/20 0.55
CSNK1A1 P48729 1/20 0.55
CSNK1D P48730 1/20 0.55
CSNK1E P49674 1/20 0.55
MAPK12 P53778 1/20 0.55
CSNK1G2 P78368 1/20 0.55
PTK6 Q13882 1/20 0.55
ERBB4 Q15303 1/20 0.55
MAPK11 Q15759 1/20 0.55

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
SCHEMBL5790306 0.92 MAPK14 (0.61) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL5790800 0.91 MAPK14 (0.60) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL5793520 0.88 MAPK14 (0.71) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL5205132 0.86 MAPK14 (0.62) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL5808419 0.85 MAPK14 (0.54) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL5805532 0.85 MAPK14 (0.54) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL5805528 0.85 MAPK14 (0.54) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL6508068 0.84 MAPK14 (0.53) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL4258909 0.80 MAPK14 (0.59) MAPK14IKBKBMAPK13PRKD3MAP4K4
SCHEMBL5790672 0.80 MAPK14 (0.69) MAPK14IKBKBMAPK13PRKD3MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050080113-A1 Medicinal compositions TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-14 US claimed
US-20040097555-A1 Concomitant drugs TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-20 US claimed
EP-1402900-A1 MEDICINAL COMPOSITIONS Takeda Chemical Industries, Ltd. (JP) 2004-03-31 EP claimed
EP-1354603-A1 CONCOMITANT DRUGS Takeda Chemical Industries, Ltd. (JP) 2003-10-22 EP claimed
US-7067527-B2 Thienopyridine derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-27 US disclosed
WO-2006006691-A2 SOLID DISPERSION OF A P38 MAP KINASE INHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-19 WO disclosed
US-6962933-B1 Method for inhibiting p38 MAP kinase or TNF-α production using a 1,3-thiazole TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-08 US disclosed
US-20050080113-A1 Medicinal compositions TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-14 US disclosed
EP-1259515-B1 THIENOPYRIDINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS TAKEDA PHARMACEUTICAL (JP) 2004-11-10 EP disclosed
US-20040097555-A1 Concomitant drugs TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-20 US disclosed
EP-1402900-A1 MEDICINAL COMPOSITIONS Takeda Chemical Industries, Ltd. (JP) 2004-03-31 EP disclosed
US-20040054183-A1 Thienopyridine derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-18 US disclosed
US-6653476-B2 Antiinflammatory and antiarthritic agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-11-25 US disclosed
EP-1354603-A1 CONCOMITANT DRUGS Takeda Chemical Industries, Ltd. (JP) 2003-10-22 EP disclosed
US-20030130517-A1 Thienopyridine derivatives , their production and use TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2003-07-10 US disclosed
EP-1259515-A2 THIENOPYRIDINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-27 EP disclosed
EP-1205478-A1 p38MAP KINASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2002-05-15 EP disclosed
WO-2001064685-A2 THIENOPYRIDINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-09-07 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 (4 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-20050080113-A1 Medicinal compositions TNF, TRAF6, MMP8 MAPK14 50/4885IKBKB 119/4885MAPK13 72/4885
US-20040097555-A1 Concomitant drugs TNF, CHUK, CNKSR1 MAPK14 29/4885IKBKB 25/4885MAPK13 50/4885
US-20030130517-A1 Thienopyridine derivatives , their production and use ALK, HRH2, TBXA2R MAPK14 2965/4885IKBKB 321/4885MAPK13 3327/4885
US-20040054183-A1 Thienopyridine derivatives, their production and use ALK, HRH2, TBXA2R MAPK14 2965/4885IKBKB 321/4885MAPK13 3327/4885

“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.