SCHEMBL10312077

SCHEMBL10312077

Cc1cc(Nc2nc(/C=C/c3cccc(C(F)(F)F)c3)nc(Nc3ccc(P(C)(C)=O)cc3)n2)n[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.46
PIK3C3 Q8NEB9 1/20 0.41
APP P05067 3/20 0.39
IDH2 P48735 3/20 0.38
SRC P12931 4/20 0.37
AURKA O14965 3/20 0.37
ABL1 P00519 3/20 0.37
NTRK1 P04629 3/20 0.37
PLK4 O00444 3/20 0.37
LCK P06239 2/20 0.37
CSF1R P07333 2/20 0.37
RET P07949 2/20 0.37
KIT P10721 2/20 0.37
FGFR1 P11362 2/20 0.37
PDGFRA P16234 2/20 0.37
TYK2 P29597 2/20 0.37
KDR P35968 2/20 0.37
FLT3 P36888 2/20 0.37
PTK2 Q05397 2/20 0.37
AURKB Q96GD4 2/20 0.37

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
SCHEMBL10312098 0.90 IDH2 (0.37) DHODHAPPIDH2SRCABL1
SCHEMBL10312219 0.89 AURKA (0.41) DHODHPIK3C3SRCAURKAABL1
SCHEMBL10312178 0.88 CCNA2 (0.45) SRC
SCHEMBL10312194 0.87 AURKA (0.41) DHODHPIK3C3SRCAURKAABL1
SCHEMBL10312052 0.80 APP (0.39) APPIDH2SRCABL1HTT
SCHEMBL10312181 0.80 IDH2 (0.48) DHODHPIK3C3IDH2SRCAURKA
SCHEMBL10312224 0.79 NTRK1 (0.50) DHODHSRCAURKAABL1NTRK1
SCHEMBL10312136 0.79 PTGS2 (0.35) SRCAURKAABL1NTRK1PLK4
SCHEMBL10312229 0.79 KDM4E (0.45) DHODHAURKAABL1NTRK1PLK4
SCHEMBL10312100 0.78 AURKA (0.32) SRCAURKAABL1NTRK1CSF1R

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 DHODH 4236/4885PIK3C3 1787/4885APP 2830/4885

“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.