SCHEMBL4801489

SCHEMBL4801489

Cn1cnc(-c2cccc(NC(=O)NCc3ccccc3)c2)c1-c1cc2c(N)ncnc2s1

nearest known ligand 0.83

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TEK Q02763 7/20 0.83
KDR P35968 7/20 0.64
FLT1 P17948 2/20 0.64
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
BRAF P15056 2/20 0.42
LIMK1 P53667 3/20 0.42
LIMK2 P53671 1/20 0.42
RET P07949 1/20 0.42
IKBKB O14920 1/20 0.39
EGFR P00533 1/20 0.39

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
SCHEMBL4800669 0.92 TEK (0.72) TEKKDRFLT1MEN1POLB
SCHEMBL4796059 0.91 TEK (1.00) TEKKDRFLT1BRAFLIMK1
SCHEMBL4802186 0.87 TEK (0.86) TEKKDRFLT1BRAFLIMK1
SCHEMBL4480247 0.85 TEK (0.85) TEKKDRFLT1BRAFLIMK1
SCHEMBL4471994 0.85 TEK (0.85) TEKKDRFLT1BRAF
SCHEMBL4467818 0.84 TEK (0.83) TEKKDRFLT1POLBBRAF
SCHEMBL4484707 0.84 TEK (0.83) TEKKDRFLT1BRAF
SCHEMBL4796015 0.84 TEK (0.86) TEKKDRFLT1LIMK1RET
SCHEMBL4471484 0.83 TEK (0.73) TEKKDRFLT1BRAF
SCHEMBL4485440 0.83 TEK (0.70) TEKKDRFLT1LIMK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7427616-B2 Condensed pyridines and pyrimidines with tie2 (TEK) activity ASTRAZENECA AB (SE) 2008-09-23 US claimed
EP-1537112-B1 CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY ASTRAZENECA AB (SE) 2006-04-19 EP claimed
US-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity ASTRAZENECA AB (SE) 2005-11-17 US claimed
US-7427616-B2 Condensed pyridines and pyrimidines with tie2 (TEK) activity ASTRAZENECA AB (SE) 2008-09-23 US disclosed
EP-1537112-B1 CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY ASTRAZENECA AB (SE) 2006-04-19 EP disclosed
US-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity ASTRAZENECA AB (SE) 2005-11-17 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-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity TIE1, TEK, KDR TEK 2/4885KDR 3/4885FLT1 6/4885

“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.