SCHEMBL10312078

SCHEMBL10312078

Cc1cc(Nc2nc(/C=C/c3cccc(C(F)(F)F)c3)nc(NC(C)c3ccncc3)n2)n[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.41
NTRK1 P04629 5/20 0.39
JAK2 O60674 4/20 0.37
JAK3 P52333 3/20 0.37
LIMK1 P53667 2/20 0.37
LIMK2 P53671 1/20 0.37
AURKA O14965 6/20 0.37
AURKB Q96GD4 3/20 0.37
PLK4 O00444 2/20 0.37
ABL1 P00519 2/20 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
SRC P12931 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

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
SCHEMBL10312096 0.90 MELK (0.34) AURKANFE2L2GRK6MELKL3MBTL1
SCHEMBL10312218 0.89 NTRK1 (0.44) NTRK1JAK2JAK3LIMK1LIMK2
SCHEMBL10312185 0.88 NTRK1 (0.47) NTRK1JAK2JAK3PAK1
SCHEMBL10312197 0.87 NTRK1 (0.42) NTRK1JAK2JAK3LIMK1LIMK2
SCHEMBL10312224 0.85 NTRK1 (0.50) DHODHNTRK1JAK2JAK3LIMK1
SCHEMBL10312029 0.81 HDAC4 (0.37) JAK2NFE2L2MELKL3MBTL1HRH4
SCHEMBL10312229 0.80 KDM4E (0.45) DHODHNTRK1JAK2JAK3LIMK1
SCHEMBL10312181 0.79 IDH2 (0.48) DHODHNTRK1JAK2JAK3LIMK1
SCHEMBL10312177 0.79 HRH4 (0.50) DHODHNTRK1JAK2JAK3LIMK1
SCHEMBL10312102 0.79 GRK6 (0.39) NTRK1JAK2JAK3LIMK1LIMK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440055-B1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY LLC (US) 2015-03-11 EP disclosed
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 4236/4885NTRK1 482/4885JAK2 176/4885

“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.