SCHEMBL5606261

SCHEMBL5606261

Cc1nc(-c2cn3ncnc(O)c3c2C(C)C)no1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.51
FGFR1 P11362 7/20 0.51
FLT1 P17948 5/20 0.36
CYP3A4 P08684 3/20 0.36
KCNH2 Q12809 1/20 0.36
FGFR2 P21802 4/20 0.36
FGFR4 P22455 4/20 0.36
FGFR3 P22607 4/20 0.36
FLT4 P35916 4/20 0.36
ERBB2 P04626 2/20 0.36
LCK P06239 2/20 0.36
EGFR P00533 1/20 0.36
PDGFRB P09619 1/20 0.36
AAK1 Q2M2I8 2/20 0.34
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL24393356 0.59 KDR (0.38) KDREGFR
SCHEMBL23939418 0.59 KDR (0.37) KDREGFR
SCHEMBL24392406 0.59 KDR (0.37) KDREGFR
SCHEMBL14883217 0.58 L3MBTL1 (0.47) CYP1A2
SCHEMBL4386662 0.57 CASP3 (0.68) CYP3A4CYP1A2CYP2C9
SCHEMBL16583512 0.56 L3MBTL1 (0.44) EGFR
SCHEMBL24392514 0.56 KDR (0.35) KDREGFR
SCHEMBL20928945 0.56 L3MBTL1 (0.45) KDRFGFR1
SCHEMBL4815952 0.56 KDR (0.42) KDRFGFR1
SCHEMBL12537638 0.55 EGFR (0.52) KDRFLT1FLT4ERBB2EGFR

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
EP-1543009-A4 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2007-08-08 EP disclosed
US-20050234060-A1 Pyrrolotriazine kinase inhibitors BHIDE RAJEEV S 2005-10-20 US disclosed
US-6951859-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2005-10-04 US disclosed
EP-1543009-A1 PYRROLOTRIAZINE KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2005-06-22 EP disclosed
US-20040063708-A1 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-04-01 US disclosed
WO-2004013145-A1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-02-12 WO 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 (2 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-20040063708-A1 Pyrrolotriazine kinase inhibitors FGFR1, FLT1, FGFR2 KDR 7/4885FGFR1 1/4885FLT1 2/4885
US-20050234060-A1 Pyrrolotriazine kinase inhibitors FGFR1, FLT1, FGFR2 KDR 7/4885FGFR1 1/4885FLT1 2/4885

“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.