SCHEMBL28830619

SCHEMBL28830619

O=C(O)c1ncsc1N(c1cccs1)S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.40
▸ DAO P14920 1/20 0.33
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA4 P22748 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ ERCC1 P07992 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ ERCC4 Q92889 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ AGTR1 P30556 1/20 0.30
▸ AGTR2 P50052 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL28076242 0.79 KDM4E (0.45) KDM4EAGTR1AGTR2
SCHEMBL28076251 0.78 BCL2L1 (0.40) KDM4ECA1CA2CA4CA9
SCHEMBL28076428 0.77 KDM4E (0.39) KDM4E
SCHEMBL28076429 0.77 KDM4E (0.36) KDM4EDAOLMNA
SCHEMBL28076253 0.76 KDM4E (0.41) KDM4ELMNA
SCHEMBL28076309 0.76 KDM4E (0.39) KDM4ECA1CA2
SCHEMBL28076423 0.75 NAMPT (0.38) KDM4E
SCHEMBL28076270 0.75 KDM4E (0.35) KDM4E
SCHEMBL28076247 0.75 DAO (0.36) KDM4EDAO
SCHEMBL28076260 0.74 KDM4E (0.40) KDM4ELMNAAGTR1AGTR2NPSR1

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-105658631-B Antibacterial thiazole carboxylic acid 安塔比奥公司 2019-06-18 — — CN claimed
CN-105658631-A Antibacterial thiazolecarboxylic acids 安塔比奥公司 2016-06-08 — — CN claimed
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