SCHEMBL3528078

SCHEMBL3528078

CSc1ncnc2cc(N)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.47
KIT P10721 1/20 0.38
KEAP1 Q14145 1/20 0.37
ERBB2 P04626 1/20 0.36
PI4KA P42356 1/20 0.36
PI4K2B Q8TCG2 1/20 0.36
PI4K2A Q9BTU6 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
MDM4 O15151 1/20 0.36
CSF1R P07333 1/20 0.36
BRAF P15056 1/20 0.36
TNNI3K Q59H18 1/20 0.36
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
F2 P00734 1/20 0.35
LMNA P02545 1/20 0.35
CHRM2 P08172 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL4420762 0.79 RET (0.43) EGFRRAB9AMEN1KDRKMT2A
SCHEMBL10548235 0.79 NR4A2 (0.43) EGFRMEN1LMNAHTTKMT2A
SCHEMBL6836416 0.75 EGFR (0.46) EGFR
SCHEMBL29663392 0.75 PI4KA (0.57) EGFRPI4KAPI4K2BPI4K2API4KB
SCHEMBL6096033 0.75 PI4KA (0.57) EGFRPI4KAPI4K2BPI4K2API4KB
SCHEMBL1780458 0.73 ALDH1A1 (0.56) EGFRPI4KAPI4K2BPI4K2API4KB
SCHEMBL29975518 0.73 ALDH1A1 (0.56) EGFRPI4KAPI4K2BPI4K2API4KB
SCHEMBL3527024 0.72 EGFR (0.52) EGFRMEN1LMNAKDRKMT2A
SCHEMBL2082154 0.72 EGFR (0.51) EGFRKITPI4KAPI4K2BPI4K2A
SCHEMBL22911854 0.72 PDE4A (0.53) EGFRERBB2PI4KAPI4K2BPI4K2A

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
US-7709479-B1 Quinazoline derivatives and their use as pharmaceuticals ASTRAZENECA (SE) 2010-05-04 US disclosed
EP-1218354-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS AstraZeneca AB (SE) 2002-07-03 EP disclosed
WO-2001021596-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS ASTRAZENECA AB (SE) 2001-03-29 WO disclosed