SCHEMBL30891782

SCHEMBL30891782

COc1cc2c(Nc3ccccc3)ncnc2cc1OCc1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.83
KDR P35968 7/20 0.83
RET P07949 5/20 0.83
LCK P06239 4/20 0.81
RIPK2 O43353 2/20 0.69
EPHB2 P29323 2/20 0.69
GAK O14976 1/20 0.67
STK10 O94804 1/20 0.67
FLT3 P36888 1/20 0.67
JAK3 P52333 1/20 0.67
AAK1 Q2M2I8 1/20 0.67
Q6ZSR9 Q6ZSR9 1/20 0.67
SLK Q9H2G2 1/20 0.67
IRAK4 Q9NWZ3 1/20 0.67
RPS6KA6 Q9UK32 1/20 0.67
ALK Q9UM73 1/20 0.67
FGFR1 P11362 1/20 0.67
FLT1 P17948 1/20 0.67
CDK2 P24941 1/20 0.67
PIK3R1 P27986 1/20 0.67

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
SCHEMBL30141491 0.92 EGFR (0.78) EGFRKDRRETLCKRIPK2
SCHEMBL242224 0.92 EGFR (0.78) EGFRKDRRETLCKRIPK2
SCHEMBL8870651 0.91 EGFR (0.81) EGFRKDRRETLCKEPHB2
SCHEMBL29515328 0.91 EGFR (1.00) EGFRKDRRETLCKRIPK2
SCHEMBL1257431 0.91 EGFR (1.00) EGFRKDRRETLCKRIPK2
Hydrochloric Acid SCHEMBL8809813 0.91 EGFR (0.76) EGFRKDRRETLCKRIPK2
SCHEMBL1387156 0.91 EGFR (0.75) EGFRKDRRETLCKRIPK2
SCHEMBL22367364 0.90 EGFR (0.81) EGFRKDRRETLCKEPHB2
SCHEMBL668572 0.90 EGFR (0.81) EGFRKDRRETLCKEPHB2
Hydrochloric Acid SCHEMBL5475737 0.90 EGFR (1.00) EGFRKDRRETLCKRIPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118201909-A Quinazoline derivative compound and use thereof 株式会社沃若诺伊 2024-06-14 CN disclosed