SCHEMBL6779976

SCHEMBL6779976

[c]1ncnc2cc3cc[nH]c3cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.39
EGFR P00533 4/20 0.36
CSNK2A1 P68400 1/20 0.35
FLT1 P17948 2/20 0.35
AHR P35869 6/20 0.34
NR4A2 P43354 2/20 0.34
CYP2A6 P11509 1/20 0.34
CMA1 P23946 1/20 0.34
F7 P08709 1/20 0.34
LTA4H P09960 1/20 0.34
F3 P13726 1/20 0.34
TYR P14679 1/20 0.34
USP2 O75604 1/20 0.34
GAA P10253 1/20 0.34
ALOX15 P16050 1/20 0.34
RAD51 Q06609 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RET P07949 1/20 0.33
IMPDH2 P12268 1/20 0.32
IMPDH1 P20839 1/20 0.32

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
SCHEMBL4416618 0.76 MAPK1 (0.42) EGFRCSNK2A1MEN1POLBMAPK1
SCHEMBL5828085 0.73 CHEK1 (0.42) EGFRCSNK2A1GAAMEN1MAPK1
SCHEMBL17511896 0.73 PI4KA (0.43) EGFRCYP2A6KMT2A
SCHEMBL7688427 0.72 MAPT (0.44)
SCHEMBL5828182 0.69 MAPT (0.44)
SCHEMBL11444870 0.69 GPR84 (0.48) GPR84EGFRCSNK2A1AHRNR4A2
SCHEMBL4421566 0.68 NPC1 (0.43) EGFRNR4A2ALOX15MEN1POLB
SCHEMBL855664 0.67 NR4A2 (0.38) EGFRNR4A2F7F3ALOX15
SCHEMBL4418271 0.67
SCHEMBL26680104 0.67 EGFR (0.50) GPR84EGFRCSNK2A1FLT1AHR

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-0635507-B1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LTD (GB) 1999-09-15 EP claimed
US-5569658-A Tricyclic derivatives ZENECA LIMITED (GB) 1996-10-29 US claimed
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
US-5569658-A Tricyclic derivatives ZENECA LIMITED (GB) 1996-10-29 US disclosed