SCHEMBL5605877

SCHEMBL5605877

CCOC(=O)c1cn2ncnc(Nc3cc(C(=O)NOC)c(F)cc3F)c2c1C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 1.00
FLT1 P17948 7/20 0.79
FLT4 P35916 7/20 0.79
FGFR1 P11362 7/20 0.68
FGFR2 P21802 6/20 0.68
FGFR4 P22455 6/20 0.68
FGFR3 P22607 6/20 0.68
ERBB2 P04626 1/20 0.68
LCK P06239 1/20 0.68
CYP1A2 P05177 1/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2C9 P11712 1/20 0.68

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
SCHEMBL5606016 0.94 KDR (0.89) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL1227532 0.90 KDR (0.81) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL5606960 0.89 KDR (0.80) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL5597080 0.89 KDR (1.00) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL5605872 0.89 KDR (1.00) KDRFLT1FLT4ERBB2
SCHEMBL5605639 0.88 KDR (1.00) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL6447823 0.85 KDR (0.83) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL5605850 0.84 KDR (0.72) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL5607151 0.84 KDR (0.87) KDRFLT1FLT4FGFR1FGFR2
SCHEMBL5605860 0.82 KDR (1.00) KDRFLT1FLT4ERBB2

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 7 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 claimed
US-20050234060-A1 Pyrrolotriazine kinase inhibitors BHIDE RAJEEV S 2005-10-20 US claimed
EP-1543009-A1 PYRROLOTRIAZINE KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2005-06-22 EP claimed
US-20040063708-A1 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-04-01 US claimed
WO-2004013145-A1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-02-12 WO claimed
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

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 7/4885FLT1 2/4885FLT4 5/4885
US-20050234060-A1 Pyrrolotriazine kinase inhibitors FGFR1, FLT1, FGFR2 KDR 7/4885FLT1 2/4885FLT4 5/4885

“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.