SCHEMBL7981320

SCHEMBL7981320

Fc1cc2c(Nc3ccccc3)ncnc2cn1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.73
ABCG2 Q9UNQ0 2/20 0.59
DAPK3 O43293 1/20 0.59
MAP4K4 O95819 1/20 0.59
ABL1 P00519 1/20 0.59
ERBB2 P04626 1/20 0.59
PIM1 P11309 1/20 0.59
PRKACA P17612 1/20 0.59
LTK P29376 1/20 0.59
MAPK8 P45983 1/20 0.59
CSNK1A1 P48729 1/20 0.59
RPS6KA3 P51812 1/20 0.59
LIMK1 P53667 1/20 0.59
MAP2K1 Q02750 1/20 0.59
ACVR1 Q04771 1/20 0.59
TYRO3 Q06418 1/20 0.59
MAP4K2 Q12851 1/20 0.59
ROCK1 Q13464 1/20 0.59
DYRK1A Q13627 1/20 0.59
MAPK14 Q16539 1/20 0.59

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
SCHEMBL18354383 0.85 EGFR (0.65) EGFRCLK4LMNACYP1A2CYP3A4
SCHEMBL7975392 0.85 EGFR (0.73) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL2988440 0.85 EGFR (1.00) EGFRABCG2ERBB2
SCHEMBL7978403 0.85 EGFR (0.73) EGFRABL1ERBB2MAPK14MAPK1
SCHEMBL7965118 0.83 EGFR (0.73) EGFRABCG2HTTKDRBRAF
SCHEMBL11965408 0.82 EGFR (0.78) EGFRABCG2DAPK3MAP4K4ABL1
SCHEMBL868020 0.82 EGFR (0.68) EGFRABCG2DAPK3ABL1ERBB2
SCHEMBL13151521 0.80 RET (0.60) EGFRRETKDRRAF1BRAF
SCHEMBL11902821 0.80 EGFR (0.70) EGFRABCG2ERBB2KDM4ELMNA
SCHEMBL11902904 0.80 GRM1 (0.64) EGFRERBB2AURKBKDRCD38

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997026259-A1 IMPROVED PROCESS FOR PREPARING 4,6-DISUBSTITUTED PYRIDO[3,4-d]PYRIMIDINES WARNER-LAMBERT COMPANY (US) 1997-07-24 WO claimed
US-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2016-02-04 US disclosed
US-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2016-02-04 US disclosed
US-9101632-B2 Kinase inhibitors, prodrug forms thereof and their use in therapy AUCKLAND UNISERVICES LIMITED (NZ) 2015-08-11 US disclosed
US-9101632-B2 Kinase inhibitors, prodrug forms thereof and their use in therapy AUCKLAND UNISERVICES LIMITED (NZ) 2015-08-11 US disclosed
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2012-08-09 US disclosed
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2012-08-09 US disclosed
US-6313292-B1 REACTION FROM 5-AMINO-2-FLUOROPYRIDINE; AMINATION, CYCLIZATION, CHLORINATION, SALT FORMATION, DECHLORINATION, DEBLOCKING WARNER-LAMBERT COMPANY 2001-11-06 US disclosed
WO-1997026259-A1 IMPROVED PROCESS FOR PREPARING 4,6-DISUBSTITUTED PYRIDO[3,4-d]PYRIMIDINES WARNER-LAMBERT COMPANY (US) 1997-07-24 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-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY ERBB2, MAP3K3, ERBB3 EGFR 110/4885ABCG2 1846/4885DAPK3 383/4885
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY ERBB2, MAP3K3, MAP3K19 EGFR 110/4885ABCG2 2026/4885DAPK3 350/4885

“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.