SCHEMBL5606315

SCHEMBL5606315

CCCc1c(C(=O)O)cn2ncnc(O)c12

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.45
EGFR P00533 5/20 0.38
ERBB2 P04626 5/20 0.38
MAPK14 Q16539 5/20 0.35
MAP2K1 Q02750 1/20 0.34
FGFR1 P11362 1/20 0.33

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
SCHEMBL4815952 0.78 KDR (0.42) KDRMAPK14MAP2K1FGFR1
SCHEMBL5606311 0.74 KDR (0.42) KDREGFRERBB2FGFR1
SCHEMBL7528805 0.74 FGFR1 (0.41) KDREGFRERBB2MAPK14FGFR1
SCHEMBL16645852 0.74 KDR (0.42) KDREGFRERBB2MAPK14MAP2K1
SCHEMBL16646778 0.71 L3MBTL1 (0.40) KDREGFR
SCHEMBL1227597 0.69 MAP2K1 (0.55) KDREGFRERBB2MAPK14MAP2K1
SCHEMBL27888153 0.69 EGFR (0.64) EGFRERBB2
SCHEMBL27871866 0.68 EGFR (0.55) KDREGFRERBB2MAPK14
SCHEMBL27576858 0.68 EGFR (0.62) KDREGFRERBB2MAP2K1
SCHEMBL27871851 0.67 EGFR (0.67) KDREGFRERBB2MAP2K1

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 7/4885EGFR 80/4885ERBB2 11/4885
US-20050234060-A1 Pyrrolotriazine kinase inhibitors FGFR1, FLT1, FGFR2 KDR 7/4885EGFR 73/4885ERBB2 10/4885

“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.