SCHEMBL29110427

SCHEMBL29110427

Cc1nc2ccc(F)cc2c(=O)n1-c1ccc(O)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.73
▸ ESR1 P03372 1/20 0.61
▸ ESR2 Q92731 1/20 0.61
▸ HRH3 Q9Y5N1 2/20 0.58
▸ KCNH2 Q12809 1/20 0.58
▸ HPD P32754 3/20 0.57
▸ PIK3CD O00329 1/20 0.54
▸ PIK3CA P42336 1/20 0.54
▸ MTOR P42345 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ GLA P06280 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ IDO1 P14902 1/20 0.51
▸ TDO2 P48775 1/20 0.51
▸ IDO2 Q6ZQW0 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ GRM1 Q13255 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ ATM Q13315 1/20 0.50

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
SCHEMBL30089869 1.00 POLB (0.73) POLBESR1ESR2HRH3KCNH2
SCHEMBL29110476 0.89 POLB (0.61) POLBESR1ESR2HRH3KCNH2
SCHEMBL22238067 0.89 POLB (0.72) POLBHRH3KCNH2HPDL3MBTL1
SCHEMBL28924646 0.88 POLB (0.71) POLBESR1ESR2HRH3KCNH2
SCHEMBL8307781 0.88 POLB (0.71) POLBHRH3KCNH2HPDPIK3CA
SCHEMBL30149472 0.88 POLB (0.71) POLBESR1ESR2HRH3KCNH2
SCHEMBL29110419 0.86 POLB (0.77) POLBESR1ESR2HRH3KCNH2
SCHEMBL30089880 0.85 HSD17B10 (0.72) POLBHRH3KCNH2HPDL3MBTL1
SCHEMBL29110466 0.85 HSD17B10 (0.72) POLBHRH3KCNH2HPDL3MBTL1
SCHEMBL31463104 0.83 NPC1 (0.71) POLBESR1ESR2HRH3KCNH2

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
CN-115521262-B Preparation method of quinazolinone containing phenyl and composition thereof, and application of quinazolinone and composition in resisting kiwi fruit canker 贵州理工学院 2024-04-05 — — CN disclosed
CN-115677803-A Preparation method of glucoside derivative containing quinazoline structure, preparation method of composition of glucoside derivative and application of composition in prevention and treatment of kiwifruit canker 贵州理工学院 2023-02-03 — — CN disclosed
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