SCHEMBL10726333

SCHEMBL10726333

NC(=S)c1ccc(NC=C(S(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc2)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.48
▸ MAPT P10636 2/20 0.45
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.36
▸ HCAR3 P49019 2/20 0.36
▸ P4HTM Q9NXG6 2/20 0.36
▸ NNMT P40261 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34

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
SCHEMBL10716578 0.89 PKM (0.49) PKMMAPTHDAC3HDAC4HDAC1
SCHEMBL10726196 0.82 PKM (0.52) PKMMAPTALDH1A1POLBCA1
SCHEMBL10726379 0.81 PKM (0.47) PKMMAPTHDAC3HDAC4HDAC1
SCHEMBL10728346 0.81 BAZ2B (0.48) PKMMAPTHDAC3HDAC4HDAC1
SCHEMBL10730568 0.81 PKM (0.51) PKMMAPTALDH1A1POLBCA1
SCHEMBL10727069 0.81 ALDH1A1 (0.52) PKMMAPTALDH1A1HCAR3P4HTM
SCHEMBL10726719 0.79 PKM (0.52) PKMMAPTHDAC3HDAC4HDAC1
SCHEMBL10717754 0.79 ALDH1A1 (0.52) PKMMAPTALDH1A1POLBCA1
SCHEMBL10731246 0.79 PKM (0.45) PKMMAPTHDAC3HDAC4HDAC1
SCHEMBL10729011 0.78 L3MBTL1 (0.50) PKMMAPTHDAC3HDAC4HDAC1

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
US-4647569-A Antiarthritic pyridylaminoethene disulfonyl compounds and use MAY & BAKER LIMITED (GB) 1987-03-03 — — US claimed
US-4647569-A Antiarthritic pyridylaminoethene disulfonyl compounds and use MAY & BAKER LIMITED (GB) 1987-03-03 — — US disclosed
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