SCHEMBL13675364

SCHEMBL13675364

C/C=C/c1nccc(Nc2cc(C)[nH]n2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITK Q08881 2/20 0.56
KDR P35968 9/20 0.48
FGFR1 P11362 7/20 0.48
IGF1R P08069 7/20 0.48
AURKA O14965 8/20 0.46
AURKB Q96GD4 8/20 0.46
EGFR P00533 3/20 0.45
SRC P12931 3/20 0.42
ABL1 P00519 3/20 0.42
LCK P06239 3/20 0.42
CSF1R P07333 3/20 0.42
RET P07949 3/20 0.42
FLT3 P36888 3/20 0.42
PTK2 Q05397 3/20 0.42
JAK2 O60674 3/20 0.42
JAK3 P52333 3/20 0.42
PLK4 O00444 2/20 0.42
NTRK1 P04629 2/20 0.42
KIT P10721 2/20 0.42
PDGFRA P16234 2/20 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
SCHEMBL13675351 0.86 ITK (0.49) ITKKDRFGFR1IGF1RAURKA
SCHEMBL13675332 0.84 ITK (0.62) ITKKDRFGFR1IGF1RAURKA
SCHEMBL18154707 0.79 ITK (0.65) ITKKDRFGFR1IGF1RAURKA
SCHEMBL30230471 0.79 ITK (0.65) ITKKDRFGFR1IGF1RAURKA
SCHEMBL29537888 0.77 ITK (0.62) ITKKDRFGFR1IGF1RAURKA
SCHEMBL2120764 0.77 ITK (0.62) ITKKDRFGFR1IGF1RAURKA
SCHEMBL18154778 0.74 ITK (0.59) ITKKDRFGFR1IGF1RAURKA
SCHEMBL18297005 0.73 ITK (0.58) ITKKDRFGFR1IGF1RAURKA
SCHEMBL802275 0.72 ITK (1.00) ITKKDRFGFR1IGF1RAURKA
SCHEMBL18154760 0.72 ITK (0.56) ITKKDRFGFR1IGF1RAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264422-A1 METHOD OF TREATING DISEASE STATES USING SUBSTITUTED PYRAZOLE COMPOUNDS MIIKANA THERAPEUTICS, INC. 2009-10-22 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-20090264422-A1 METHOD OF TREATING DISEASE STATES USING SUBSTITUTED PYRAZOLE COMPOUNDS AURKC, AURKA, AURKB ITK 1059/4885KDR 2717/4885FGFR1 1382/4885

“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.