SCHEMBL2287097

SCHEMBL2287097

N#Cc1ccc2[nH]c(-c3ccccc3)c(-c3ccc(F)cc3)c2n1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 11/20 0.80
MAPK14 Q16539 5/20 0.51
RAF1 P04049 2/20 0.46
DYRK1A Q13627 2/20 0.46
MAPK13 O15264 1/20 0.46
MAPK12 P53778 1/20 0.46
MAPK11 Q15759 1/20 0.46
PTGS2 P35354 2/20 0.41

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
SCHEMBL2188232 0.89 MET (1.00) METMAPK14RAF1DYRK1AMAPK13
SCHEMBL2286561 0.89 MET (1.00) METMAPK14RAF1DYRK1AMAPK13
SCHEMBL2286057 0.87 MET (0.77) METMAPK14RAF1
SCHEMBL2293156 0.86 MET (0.74) METMAPK14RAF1DYRK1AMAPK13
SCHEMBL12414715 0.86 MET (1.00) METMAPK14RAF1DYRK1AMAPK13
SCHEMBL2289909 0.85 MET (0.91) METMAPK14MAPK13MAPK12MAPK11
SCHEMBL2186136 0.85 MET (1.00) METMAPK14RAF1DYRK1AMAPK13
SCHEMBL2289893 0.83 MET (0.69) METMAPK14MAPK13MAPK12MAPK11
SCHEMBL2288612 0.82 MET (0.68) METMAPK14
SCHEMBL2286491 0.82 MET (0.70) METMAPK14RAF1DYRK1AMAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110207732-A1 AZAINDOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-08-25 US claimed
US-20110207732-A1 AZAINDOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-08-25 US disclosed
WO-2010046013-A1 AZAINDOLE DERIVATIVE MERCK PATENT GMBH (DE) 2010-04-29 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-20110207732-A1 AZAINDOLE DERIVATIVES AZI2, ABL1, RET MET 8/4885MAPK14 818/4885RAF1 281/4885

“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.