SCHEMBL10827670

SCHEMBL10827670

Cn1c(CSC#N)nc2ccc(S(C)(=O)=O)cc2c1=O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PARG Q86W56 8/20 0.44
▸ ACSS2 Q9NR19 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ PDE5A O76074 2/20 0.35
▸ HDAC6 Q9UBN7 2/20 0.35
▸ HDAC8 Q9BY41 1/20 0.33
▸ NPBWR1 P48145 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ L3MBTL1 Q9Y468 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
SCHEMBL10828363 0.91 TDP1 (0.36) PARGACSS2TDP1POLBHDAC6
SCHEMBL10828444 0.85 TSHR (0.41) PARGTDP1POLBKDM4ETSHR
SCHEMBL10827391 0.84 ALDH1A1 (0.43) PDE5AHDAC6HDAC8KDM4ETSHR
SCHEMBL10827385 0.82 KDM4E (0.44) TDP1POLBKDM4EALOX15TSHR
SCHEMBL3821330 0.81 PARG (0.50) PARGACSS2TDP1PDE5AHDAC6
SCHEMBL10827144 0.81 ALDH1A1 (0.42) PARGALOX15TSHRL3MBTL1
SCHEMBL10827107 0.79 DDR1 (0.38) TDP1POLBHDAC6KDM4E
SCHEMBL5741084 0.78 PARG (0.47) PARGACSS2PDE5AHDAC6HDAC8
SCHEMBL10827387 0.77 ALDH1A1 (0.44) KDM4ETSHR
SCHEMBL10827126 0.76 TSHR (0.41) TDP1POLBKDM4ETSHRL3MBTL1

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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