SCHEMBL7979991

SCHEMBL7979991

COc1cc2ncnc(Nc3ccc4[nH]ccc4c3)c2cc1/C=C/c1ccc(N)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.63
RET P07949 6/20 0.60
ERBB2 P04626 1/20 0.58
CLK1 P49759 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
KDR P35968 4/20 0.47
LCK P06239 2/20 0.47
FLT1 P17948 1/20 0.46
KIF5B P33176 1/20 0.45
RAF1 P04049 1/20 0.44
BRAF P15056 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
SCHEMBL7979994 1.00 EGFR (0.63) EGFRRETERBB2CLK1ABCG2
SCHEMBL7978417 0.93 RET (0.60) EGFRRETERBB2CLK1ABCG2
SCHEMBL7978415 0.93 RET (0.60) EGFRRETERBB2CLK1ABCG2
SCHEMBL7980428 0.92 RET (0.61) EGFRRETERBB2CLK1ABCG2
SCHEMBL7980425 0.92 RET (0.61) EGFRRETERBB2CLK1ABCG2
SCHEMBL7978493 0.91 RET (0.62) EGFRRETERBB2CLK1ABCG2
SCHEMBL7978490 0.91 RET (0.62) EGFRRETERBB2CLK1ABCG2
SCHEMBL7979945 0.91 RET (0.60) EGFRRETERBB2CLK1ABCG2
SCHEMBL7979943 0.91 RET (0.60) EGFRRETERBB2CLK1ABCG2
SCHEMBL7982973 0.91 RET (0.55) EGFRRETERBB2CLK1ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0837063-A1 4-Aminoquinazoline derivatives PFIZER INC. (US) 1998-04-22 EP claimed
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