SCHEMBL28961933

SCHEMBL28961933

Cc1nc2cc(F)ccc2c(=O)n1-c1ccc(S)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.60
▸ HRH3 Q9Y5N1 4/20 0.57
▸ KCNH2 Q12809 2/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ GLA P06280 1/20 0.51
▸ HDAC3 O15379 1/20 0.48
▸ APP P05067 1/20 0.48
▸ HDAC4 P56524 1/20 0.48
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC7 Q8WUI4 1/20 0.48
▸ HDAC2 Q92769 1/20 0.48
▸ HDAC10 Q969S8 1/20 0.48
▸ HDAC11 Q96DB2 1/20 0.48
▸ HDAC8 Q9BY41 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ HDAC9 Q9UKV0 1/20 0.48
▸ HDAC5 Q9UQL6 1/20 0.48
▸ TRPV4 Q9HBA0 3/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ TSHR P16473 1/20 0.46

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
SCHEMBL28924646 0.89 POLB (0.71) POLBHRH3KCNH2L3MBTL1GLA
SCHEMBL30149472 0.89 POLB (0.71) POLBHRH3KCNH2L3MBTL1GLA
SCHEMBL29110476 0.88 POLB (0.61) POLBHRH3KCNH2L3MBTL1GLA
SCHEMBL28924717 0.86 POLB (0.59) POLBHRH3KCNH2HDAC3APP
SCHEMBL28924732 0.84 KMT2A (0.58) POLBHRH3KCNH2HDAC3APP
SCHEMBL29103865 0.80 MAPK1 (0.70) POLBHRH3KCNH2L3MBTL1MAPK1
SCHEMBL29110401 0.79 HSD17B10 (0.72) POLBHRH3KCNH2L3MBTL1GLA
SCHEMBL28924692 0.78 POLB (0.50) POLBHRH3KCNH2L3MBTL1GLA
SCHEMBL30149515 0.78 POLB (0.50) POLBHRH3KCNH2L3MBTL1GLA
SCHEMBL28924733 0.78 POLB (0.75) POLBHRH3KCNH2HDAC1HDAC2

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-115521261-B Preparation method of mercapto-containing quinazolinone and composition thereof, and application of mercapto-containing quinazolinone in resisting kiwi fruit canker 贵州理工学院 2024-04-05 — — CN disclosed
CN-115521261-A Preparation method of sulfhydryl-containing quinazolinone and composition thereof and application of sulfhydryl-containing quinazolinone in resisting kiwifruit canker 贵州理工学院 2022-12-27 — — CN disclosed
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