SCHEMBL2598723

SCHEMBL2598723

Cc1cc2cc(Nc3nc(N)ncc3Cc3ccc4cc[nH]c4c3)ccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.44
VCP P55072 4/20 0.40
KDR P35968 3/20 0.40
PDGFRB P09619 1/20 0.40
BACE1 P56817 1/20 0.39
SYK P43405 3/20 0.39
FGFR2 P21802 1/20 0.37
FLT3 P36888 1/20 0.37
ULK1 O75385 1/20 0.37
FLT1 P17948 2/20 0.36
ABL1 P00519 1/20 0.36
CYP2A6 P11509 1/20 0.36
KEAP1 Q14145 1/20 0.36
RET P07949 1/20 0.35

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
SCHEMBL2598501 0.93 EGFR (0.45) EGFRVCPKDRPDGFRBSYK
SCHEMBL16494108 0.87 ABL1 (0.40) VCPBACE1ABL1
SCHEMBL16494281 0.85 SYK (0.43) EGFRVCPKDRBACE1SYK
SCHEMBL2598697 0.85 EGFR (0.46) EGFRVCPKDRFLT1CYP2A6
SCHEMBL16494991 0.84 EGFR (0.47) EGFRVCPKDRSYKFLT1
SCHEMBL2598645 0.84 MAPKAPK2 (0.47) EGFRVCPSYKRET
SCHEMBL2598775 0.84 KDR (0.48) EGFRKDRPDGFRBSYKFGFR2
SCHEMBL2598616 0.81 LMNA (0.41) VCPABL1
SCHEMBL2598701 0.79 KDR (0.42) EGFRKDRPDGFRBSYKFGFR2
SCHEMBL2598757 0.79 KDR (0.43) EGFRKDRPDGFRBSYKFGFR2

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
EP-2571867-B1 NOVEL PYRIMIDINE DERIVATIVES NOVIGA RES AB (SE) 2015-11-04 EP claimed
US-8927547-B2 Pyrimidine derivatives NOVIGA RESEARCH AB (SE) 2015-01-06 US claimed
US-20130089518-A1 NOVEL PYRIMIDINE DERIVATIVES CHEMILIA AB (SE) 2013-04-11 US claimed
EP-2571867-B1 NOVEL PYRIMIDINE DERIVATIVES NOVIGA RES AB (SE) 2015-11-04 EP disclosed
US-8927547-B2 Pyrimidine derivatives NOVIGA RESEARCH AB (SE) 2015-01-06 US disclosed
US-20130089518-A1 NOVEL PYRIMIDINE DERIVATIVES CHEMILIA AB (SE) 2013-04-11 US disclosed
EP-2571867-A1 NOVEL PYRIMIDINE DERIVATIVES Chemilia AB (SE) 2013-03-27 EP disclosed
EP-2395001-A1 Novel pyrimidine derivatives Chemilia AB (SE) 2011-12-14 EP disclosed
WO-2011144742-A1 NOVEL PYRIMIDINE DERIVATIVES CHEMILIA AB (SE) 2011-11-24 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 (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-20130089518-A1 NOVEL PYRIMIDINE DERIVATIVES DPYD, TYMS, TYMP EGFR 2598/4885VCP 4359/4885KDR 1568/4885

“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.