SCHEMBL6184839

SCHEMBL6184839

NC(=O)NCc1cccc(Nc2n[nH]c3ncnc(Nc4cccc(Cl)c4)c23)c1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.72
CDK1 P06493 11/20 0.72
SRC P12931 10/20 0.72
ABL1 P00519 15/20 0.68
PRKCA P17252 9/20 0.68
AURKA O14965 2/20 0.50
RPS6KB1 P23443 1/20 0.50
ABL2 P42684 2/20 0.49
PDGFRB P09619 1/20 0.49
PDGFRA P16234 1/20 0.49
AURKB Q96GD4 1/20 0.46

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
SCHEMBL6186191 0.93 EGFR (0.67) EGFRCDK1SRCABL1PRKCA
SCHEMBL8125545 0.91 EGFR (0.71) EGFRCDK1SRCABL1PRKCA
SCHEMBL6186563 0.90 EGFR (0.70) EGFRCDK1SRCABL1PRKCA
SCHEMBL6186710 0.90 EGFR (0.72) EGFRCDK1SRCABL1PRKCA
SCHEMBL8577283 0.89 EGFR (0.68) EGFRCDK1SRCABL1PRKCA
SCHEMBL6191605 0.88 EGFR (0.66) EGFRCDK1SRCABL1PRKCA
SCHEMBL6190152 0.87 EGFR (0.65) EGFRCDK1SRCABL1PRKCA
SCHEMBL6186182 0.86 EGFR (0.64) EGFRCDK1SRCABL1PRKCA
SCHEMBL8125459 0.85 EGFR (0.74) EGFRCDK1SRCABL1PRKCA
SCHEMBL6186042 0.85 EGFR (0.67) EGFRCDK1SRCABL1PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0929553-B1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NOVARTIS AG (CH) 2005-03-16 EP disclosed
US-6251911-B1 Pyrimidine derivatives and processes for the preparation thereof NOVARTIS AG (CH) 2001-06-26 US disclosed
EP-0929553-A1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Novartis AG (CH) 1999-07-21 EP disclosed
WO-1998014450-A1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NOVARTIS AG (CH) 1998-04-09 WO disclosed