SCHEMBL10828363

SCHEMBL10828363

Cn1c(CSC#N)nc2cc(S(C)(=O)=O)ccc2c1=O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.36
▸ POLB P06746 1/20 0.36
▸ PARG Q86W56 1/20 0.36
▸ HDAC6 Q9UBN7 2/20 0.35
▸ ACSS2 Q9NR19 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.33
▸ DHFR P00374 1/20 0.33
▸ PTGS2 P35354 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ LRRK2 Q5S007 2/20 0.32
▸ CA12 O43570 2/20 0.31
▸ CA1 P00915 2/20 0.31
▸ CA2 P00918 2/20 0.31
▸ CA9 Q16790 2/20 0.31
▸ AKR1B1 P15121 1/20 0.31
▸ GCK P35557 1/20 0.31

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
SCHEMBL10827670 0.91 PARG (0.44) TDP1POLBPARGHDAC6ACSS2
SCHEMBL10827126 0.85 TSHR (0.41) TDP1POLBKDM4ETSHRL3MBTL1
SCHEMBL10827387 0.84 ALDH1A1 (0.44) KDM4ETSHRCA12CA1CA2
SCHEMBL10827069 0.82 CYP3A4 (0.46) TDP1KDM4EALOX15TSHRL3MBTL1
SCHEMBL10827674 0.79 PDE10A (0.41) TDP1POLBHDAC6KDM4EL3MBTL1
SCHEMBL10828444 0.76 TSHR (0.41) TDP1POLBPARGKDM4ETSHR
SCHEMBL10827391 0.76 ALDH1A1 (0.43) HDAC6HDAC8KDM4ETSHR
SCHEMBL10827385 0.75 KDM4E (0.44) TDP1POLBKDM4EALOX15TSHR
SCHEMBL10827144 0.73 ALDH1A1 (0.42) PARGPTGS2ALOX15TSHRL3MBTL1
SCHEMBL3821330 0.71 PARG (0.50) TDP1PARGHDAC6ACSS2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4605657-A 4-quinazalone fungicides CHEVRON RESEARCH COMPANY (US) 1986-08-12 — — US disclosed
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