SCHEMBL7980372

SCHEMBL7980372

COc1cc2ncnc(Nc3ccc4[nH]ccc4c3)c2cc1-c1cncc(CO)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.60
ERBB2 P04626 2/20 0.60
RET P07949 5/20 0.57
FLT1 P17948 2/20 0.51
BRAF P15056 4/20 0.50
RAF1 P04049 3/20 0.50
KDR P35968 3/20 0.47
KIF5B P33176 1/20 0.47
PIK3CA P42336 1/20 0.45
PIK3CG P48736 1/20 0.45
CLK1 P49759 1/20 0.45
ABCG2 Q9UNQ0 1/20 0.45
LCK P06239 1/20 0.45
GAK O14976 1/20 0.44
RIPK2 O43353 1/20 0.44
STK10 O94804 1/20 0.44
FLT3 P36888 1/20 0.44
JAK3 P52333 1/20 0.44
AAK1 Q2M2I8 1/20 0.44
Q6ZSR9 Q6ZSR9 1/20 0.44

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
SCHEMBL7978607 0.87 EGFR (0.60) EGFRERBB2RETFLT1BRAF
SCHEMBL7978595 0.86 EGFR (0.62) EGFRERBB2RETBRAFRAF1
SCHEMBL7982980 0.86 EGFR (0.61) EGFRERBB2RETBRAFRAF1
SCHEMBL7980482 0.85 RET (0.58) EGFRERBB2RETBRAFRAF1
SCHEMBL7980714 0.84 EGFR (0.61) EGFRERBB2RETBRAFRAF1
SCHEMBL7980461 0.84 EGFR (0.61) EGFRERBB2RETFLT1BRAF
SCHEMBL7978778 0.83 EGFR (0.60) EGFRERBB2RETFLT1BRAF
SCHEMBL7966561 0.82 RET (0.60) EGFRERBB2RETFLT1BRAF
SCHEMBL7966337 0.82 RET (0.60) EGFRERBB2RETFLT1BRAF
SCHEMBL8561433 0.81 RET (0.83) EGFRERBB2RETFLT1KDR

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
US-6225318-B1 4-aminoquinazolone derivatives PFIZER INC 2001-05-01 US disclosed
EP-0837063-A1 4-Aminoquinazoline derivatives PFIZER INC. (US) 1998-04-22 EP disclosed