SCHEMBL9017048

SCHEMBL9017048

Fc1ccc2ncnc(Nc3ccccc3)c2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.70
MAPK1 P28482 2/20 0.68
KDM4E B2RXH2 1/20 0.68
HTT P42858 1/20 0.68
ABCG2 Q9UNQ0 2/20 0.67
CLK4 Q9HAZ1 3/20 0.66
DAPK3 O43293 1/20 0.66
MAP4K4 O95819 1/20 0.66
ABL1 P00519 1/20 0.66
ERBB2 P04626 1/20 0.66
PIM1 P11309 1/20 0.66
PRKACA P17612 1/20 0.66
LTK P29376 1/20 0.66
MAPK8 P45983 1/20 0.66
CSNK1A1 P48729 1/20 0.66
RPS6KA3 P51812 1/20 0.66
LIMK1 P53667 1/20 0.66
MAP2K1 Q02750 1/20 0.66
ACVR1 Q04771 1/20 0.66
TYRO3 Q06418 1/20 0.66

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
SCHEMBL27878333 0.90 USP2 (0.65) EGFRABCG2CLK4RAF1BRAF
SCHEMBL8933760 0.89 KDR (0.73) EGFRMAPK1KDM4EHTTCLK4
Hydrochloric Acid SCHEMBL8808497 0.88 KDR (0.71) EGFRHTTERBB2KDR
SCHEMBL5569052 0.88 EGFR (0.70) EGFRMAPK1KDM4EHTTABCG2
Hydrochloric Acid SCHEMBL11087812 0.86 EGFR (0.68) EGFRMAPK1KDM4EHTTABCG2
SCHEMBL4738649 0.84 EGFR (0.80) EGFRKDM4EHTTABCG2ERBB2
SCHEMBL8427296 0.84 EGFR (0.74) EGFRMAPK1KDM4EHTTABCG2
Hydrochloric Acid SCHEMBL8427224 0.83 EGFR (0.72) EGFRMAPK1KDM4EHTTABCG2
Hydrochloric Acid SCHEMBL8812620 0.83 EGFR (0.76) EGFRCLK4ERBB2AURKBKDR
SCHEMBL8225745 0.83 KDM4E (0.73) EGFRMAPK1KDM4EHTTABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520722-B1 Therapeutic preparations containing quinazoline derivatives ZENECA LTD (GB) 1996-12-27 EP disclosed
EP-0520722-A1 Therapeutic preparations containing quinazoline derivatives ZENECA LIMITED (GB) 1992-12-30 EP disclosed