SCHEMBL24153254

SCHEMBL24153254

O=C1Nc2ccc(S(=O)(=O)Nc3ccc(C(=O)NO)cc3)cc2/C1=C\c1nccs1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TLK2 Q86UE8 10/20 0.44
▸ PRKDC P78527 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ PDPK1 O15530 1/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ HDAC3 O15379 2/20 0.40
▸ HDAC11 Q96DB2 2/20 0.40
▸ HDAC8 Q9BY41 2/20 0.40
▸ HDAC6 Q9UBN7 2/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ CTDSP1 Q9GZU7 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL24151550 0.91 GAA (0.52) TLK2PRKDCGAAPDPK1JAK3
SCHEMBL24152341 0.89 NPC1 (0.46) TLK2PRKDCGAAPDPK1JAK3
SCHEMBL24153211 0.88 JAK3 (0.44) TLK2PRKDCGAAPDPK1JAK3
SCHEMBL24152344 0.88 KMT2A (0.52) TLK2PRKDCPDPK1JAK3KMT2A
SCHEMBL24152343 0.87 KMT2A (0.51) TLK2PRKDCJAK3HDAC3HDAC11
SCHEMBL24151549 0.87 RXFP1 (0.49) TLK2PRKDCPDPK1JAK3KMT2A
SCHEMBL24153266 0.86 NPC1 (0.45) GAAMEN1KMT2APOLBALDH1A1
SCHEMBL24151582 0.85 PDPK1 (0.43) TLK2PRKDCPDPK1JAK3MAPT
SCHEMBL24152827 0.85 PRKDC (0.41) TLK2PRKDCGAAPDPK1JAK3
SCHEMBL24152342 0.85 NPC1 (0.46) GAAPOLBALDH1A1

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
WO-2021260722-A1 DESIGN, SYNTHESIS OF NOVEL OXYINDOLE INHIBITORS OF DENV RNA DEPENDENT RNA POLYMERASE TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) 2021-12-30 — — WO disclosed
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