SCHEMBL13503299

SCHEMBL13503299

CC(=O)Nc1ccc(-c2cnc3c(-c4cccc(N5CCNCC5)c4)cnn3c2N)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 17/20 0.76
KDR P35968 17/20 0.76
HCK P08631 15/20 0.76
SRC P12931 13/20 0.76
PLK4 O00444 1/20 0.52
AURKA O14965 1/20 0.52
DYRK3 O43781 1/20 0.52
ROCK2 O75116 1/20 0.52
MAP4K4 O95819 1/20 0.52
ABL1 P00519 1/20 0.52
EGFR P00533 1/20 0.52
NTRK1 P04629 1/20 0.52
FYN P06241 1/20 0.52
CDK1 P06493 1/20 0.52
FES P07332 1/20 0.52
CSF1R P07333 1/20 0.52
LYN P07948 1/20 0.52
RET P07949 1/20 0.52
KIT P10721 1/20 0.52
FGFR1 P11362 1/20 0.52

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
SCHEMBL3587520 0.87 LCK (1.00) LCKKDRHCKSRCABL1
SCHEMBL3591970 0.86 LCK (0.80) LCKKDRHCKSRCABL1
SCHEMBL13503290 0.82 KDR (0.71) LCKKDRHCKSRCPLK4
SCHEMBL13503293 0.79 LCK (0.81) LCKKDRHCKSRC
SCHEMBL3590786 0.77 LCK (0.85) LCKKDRHCKSRCABL1
SCHEMBL3589588 0.77 LCK (0.70) LCKKDRHCKSRCABL1
SCHEMBL4177466 0.76 LCK (1.00) LCKKDRHCKSRC
SCHEMBL13503283 0.76 LCK (0.85) LCKKDRHCKSRC
SCHEMBL3593879 0.75 KDR (0.62) LCKKDRHCKSRCABL1
SCHEMBL13503276 0.75 LCK (0.83) LCKKDRHCKSRCABL1

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-20100029636-A1 Lck inhibitors NOVARTIS AG (CH) 2010-02-04 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-20100029636-A1 Lck inhibitors LCK, ZAP70, FYN LCK 1/4885KDR 1630/4885HCK 42/4885

“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.