SCHEMBL4746293

SCHEMBL4746293

Nc1ncnc2cccc(Oc3ccccc3)c12

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 4/20 0.50
LCK P06239 6/20 0.45
TEK Q02763 6/20 0.45
PIK3CD O00329 2/20 0.45
PIK3CA P42336 2/20 0.45
PIK3CB P42338 2/20 0.45
PIK3CG P48736 2/20 0.45
PRKDC P78527 2/20 0.45
NUDT14 O95848 2/20 0.45
NUDT5 Q9UKK9 2/20 0.45
PI4KA P42356 2/20 0.44
PI4K2B Q8TCG2 2/20 0.44
PI4K2A Q9BTU6 2/20 0.44
PI4KB Q9UBF8 2/20 0.44
DCPS Q96C86 1/20 0.44
SRC P12931 4/20 0.40
KDR P35968 4/20 0.40
EGFR P00533 1/20 0.39
IKBKB O14920 1/20 0.39

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
SCHEMBL2124448 0.88 MAP4K4 (0.42) MAP4K4LCKTEKPIK3CDPIK3CA
SCHEMBL2128198 0.86 DCPS (0.55) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL2125597 0.86 RET (0.44) MAP4K4LCKTEKPIK3CDPIK3CA
SCHEMBL2126512 0.86 MAP4K4 (0.51) MAP4K4LCKTEKPIK3CDPIK3CA
SCHEMBL2128153 0.84 MAP4K4 (0.55) MAP4K4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2125109 0.81 NOS1 (0.41) MAP4K4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL18312193 0.78 DCPS (0.60) MAP4K4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6485667 0.77 DCPS (0.64) DCPS
Hydrochloric Acid SCHEMBL28184981 0.77 DCPS (0.58) MAP4K4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL4747815 0.76 EGFR (0.44) TEKSRCKDREGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1296973-B1 GUANIDINE DERIVATIVES OF QUINAZOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2008-11-05 EP disclosed
EP-1218353-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LTD (GB) 2007-10-17 EP disclosed
US-7001904-B1 Guanidine derivatives quinazoline and quinoline for use in the treatment of autoimmune diseases ASTRAZENECA AB (SE) 2006-02-21 US disclosed
US-6806274-B1 IMMUNOREGULATION OR IMMUNOSUPPRESSIVE AGENTS; TYROSINE KINASE INHIBITORS; PREVENTING ORGAN TRANSPLANT REJECTION; AUTOIMMUNE CONDITIONS; REDUCED SIDE EFFECTS ASTRAZENECA UK LIMITED (GB) 2004-10-19 US disclosed
EP-1296973-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES AstraZeneca AB (SE) 2003-04-02 EP disclosed
EP-1218353-A1 QUINAZOLINE DERIVATIVES AstraZeneca UK Limited (GB) 2002-07-03 EP disclosed
WO-2002002534-A1 QUINAZOLINES WITH THERAPEUTIC USE ASTRAZENECA AB (SE) 2002-01-10 WO disclosed
WO-2002000644-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2002-01-03 WO disclosed
WO-2001004102-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 2001-01-18 WO disclosed