SCHEMBL29110396

SCHEMBL29110396

Cc1ccc2c(=O)n(-c3cccc(O)c3)c(C)nc2c1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.62
▸ GAA P10253 2/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ LMNA P02545 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC10 Q969S8 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ PIK3R2 O00459 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ HTT P42858 1/20 0.41
▸ ALOX15 P16050 1/20 0.41

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
SCHEMBL30089884 1.00 HSD17B10 (0.62) HSD17B10GAAMEN1KMT2AALDH1A1
SCHEMBL29110437 0.86 HSD17B10 (0.69) HSD17B10GAAMEN1KMT2AALDH1A1
SCHEMBL30089887 0.86 HSD17B10 (0.69) HSD17B10GAAMEN1KMT2AALDH1A1
SCHEMBL29110432 0.83 ESR1 (0.50) HSD17B10GAAALDH1A1LMNAPOLB
SCHEMBL30089881 0.82 HSD17B10 (0.66) HSD17B10GAAMEN1KMT2AALDH1A1
SCHEMBL29110474 0.82 HSD17B10 (0.66) HSD17B10GAAMEN1KMT2AALDH1A1
SCHEMBL28924794 0.77 POLB (0.44) HSD17B10GAAALDH1A1LMNAPOLB
SCHEMBL29110441 0.75 HSD17B10 (0.72) HSD17B10GAAMEN1KMT2AALDH1A1
SCHEMBL29110445 0.75 HSD17B10 (0.71) HSD17B10GAAMEN1KMT2AALDH1A1
SCHEMBL30089868 0.75 HSD17B10 (0.71) HSD17B10GAAMEN1KMT2AALDH1A1

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
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
CN-115521262-A Preparation method of phenyl-containing quinazolinone and composition thereof and application of phenyl-containing quinazolinone in resisting kiwifruit canker 贵州理工学院 2022-12-27 — — CN disclosed
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