SCHEMBL10312176

SCHEMBL10312176

Cc1cc(Nc2nc(/C=C/c3cccc(C(F)(F)F)c3)nc(NCCCN3CCOCC3)n2)n[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MELK Q14680 1/20 0.46
GRK6 P43250 1/20 0.42
LCK P06239 3/20 0.42
MAPK14 Q16539 1/20 0.42
AURKA O14965 4/20 0.42
FLT3 P36888 10/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
PLK4 O00444 2/20 0.40
ABL1 P00519 2/20 0.40
NTRK1 P04629 2/20 0.40
CSF1R P07333 2/20 0.40
RET P07949 2/20 0.40
KIT P10721 2/20 0.40
FGFR1 P11362 2/20 0.40
SRC P12931 2/20 0.40
PDGFRA P16234 2/20 0.40
TYK2 P29597 2/20 0.40
KDR P35968 2/20 0.40
PTK2 Q05397 2/20 0.40

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
SCHEMBL10312123 0.91 MELK (0.45) MELKGRK6LCKMAPK14AURKA
SCHEMBL10312201 0.90 FLT3 (0.46) GRK6LCKAURKAFLT3PLK4
SCHEMBL10312190 0.89 MELK (0.44) MELKFLT3KEAP1NFE2L2NTRK1
SCHEMBL10312118 0.88 FLT3 (0.46) GRK6LCKAURKAFLT3PLK4
SCHEMBL10312072 0.86 IDH2 (0.41) LCKAURKAFLT3PLK4ABL1
SCHEMBL10312075 0.83 USP2 (0.50) LCKAURKAFLT3PLK4ABL1
SCHEMBL10312034 0.83 MELK (0.45) MELKLCKMAPK14AURKAFLT3
SCHEMBL10312199 0.81 FLT3 (0.45) MELKGRK6AURKAFLT3GSK3A
SCHEMBL10312150 0.80 IGF1R (0.48) FLT3NTRK1IGF1R
SCHEMBL10312149 0.79 FLT3 (0.45) GRK6FLT3FGFR1SRCKDR

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-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-12 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-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS STK25, STK35, SGK2 MELK 169/4885GRK6 101/4885LCK 95/4885

“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.