SCHEMBL21153073

SCHEMBL21153073

N=C(N)c1ccc(/N=N/c2c(N)ncc3ccc(F)cc23)nc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.56
KIT P10721 1/20 0.56
NTRK3 Q16288 1/20 0.56
ST14 Q9Y5Y6 1/20 0.38
F10 P00742 2/20 0.33
CTDSP1 Q9GZU7 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
F2 P00734 2/20 0.32
PLG P00747 2/20 0.32
PLAU P00749 2/20 0.32
PLAT P00750 2/20 0.32
PRSS1 P07477 2/20 0.32
KLK1 P06870 1/20 0.32
MAP4K4 O95819 1/20 0.32
UBE2T Q9NPD8 2/20 0.30
CHEK2 O96017 1/20 0.30

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
SCHEMBL21153067 0.86 FLT3 (0.56) FLT3KITNTRK3ST14F10
SCHEMBL17469648 0.86 KIT (0.75) FLT3KITNTRK3ST14F10
SCHEMBL17469789 0.83 KIT (0.52) FLT3KITNTRK3ST14TDP1
SCHEMBL21152352 0.79 KIT (0.49) FLT3KITNTRK3ST14
SCHEMBL21153071 0.77 KIT (0.56) FLT3KITNTRK3ST14CTDSP1
SCHEMBL17469650 0.72 FLT3 (0.75) FLT3KITNTRK3ST14F10
SCHEMBL17469652 0.72 KIT (0.75) FLT3KITNTRK3ST14TDP1
SCHEMBL17469649 0.72 KIT (1.00) FLT3KITNTRK3ST14TDP1
SCHEMBL21152053 0.71 KIT (0.44) FLT3KITNTRK3TDP1PLAU
SCHEMBL17469651 0.70 FLT3 (0.71) FLT3KITNTRK3ST14TDP1

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-20190209548-A1 LINKED DIARYL COMPOUNDS WITH ANTICANCER PROPERTIES AND METHODS OF USING THE SAME UNIVERSITY OF MARYLAND, BALTIMORE 2019-07-11 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-20190209548-A1 LINKED DIARYL COMPOUNDS WITH ANTICANCER PROPERTIES AND METHODS OF USING THE SAME MCL1, DPYD, TOP2B FLT3 2354/4885KIT 2616/4885NTRK3 4453/4885

“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.