SCHEMBL2883408

SCHEMBL2883408

NC(=O)c1cc(-c2[nH]c3cccnc3c2-c2ccc(F)cc2)ccn1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.65
MAPK13 O15264 2/20 0.58
MAPK12 P53778 2/20 0.58
MAPK11 Q15759 2/20 0.58
PRKD1 Q15139 1/20 0.58
TGFBR1 P36897 9/20 0.53
TGFBR2 P37173 6/20 0.53

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
SCHEMBL2886849 0.81 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL2892846 0.81 TGFBR1 (0.80) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL284987 0.79 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL16573727 0.79 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL2891452 0.78 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL2891170 0.78 MAPK14 (0.72) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL2286610 0.78 MAPK14 (0.82) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL2890929 0.76 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL2887280 0.75 MAPK14 (0.94) MAPK14MAPK13MAPK12MAPK11PRKD1
SCHEMBL18076173 0.74 MKNK1 (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084395-B2 4-aza indole derivatives and their use as fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-12-27 US disclosed
US-8084395-B2 4-aza indole derivatives and their use as fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-12-27 US disclosed
US-8084395-B2 4-aza indole derivatives and their use as fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-12-27 US disclosed
US-20100184598-A1 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-07-22 US disclosed
US-20100184598-A1 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-07-22 US disclosed
US-20100184598-A1 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-07-22 US disclosed
EP-2136640-A2 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES Syngeta Participations AG (CH) 2009-12-30 EP disclosed
WO-2008132434-A2 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-11-06 WO disclosed
WO-2008132434-A2 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-11-06 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-20100184598-A1 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES IDO1, INMT, AZI2 MAPK14 512/4885MAPK13 1175/4885MAPK12 1405/4885

“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.