SCHEMBL24151582

SCHEMBL24151582

O=Cc1ccc(NS(=O)(=O)c2ccc3c(c2)/C(=C\c2nccs2)C(=O)N3)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 2/20 0.43
▸ PRKDC P78527 1/20 0.42
▸ TLK2 Q86UE8 2/20 0.41
▸ JAK3 P52333 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ CTDSP1 Q9GZU7 1/20 0.38
▸ MGAT2 Q10469 1/20 0.38
▸ BRD4 O60885 1/20 0.38
▸ APP P05067 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ SRC P12931 1/20 0.38

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 0.87 GAA (0.52) PDPK1PRKDCTLK2JAK3MGAT2
SCHEMBL24153254 0.85 TLK2 (0.44) PDPK1PRKDCTLK2JAK3ALDH1A1
SCHEMBL24153211 0.84 JAK3 (0.44) PDPK1PRKDCTLK2JAK3CDK2
SCHEMBL24152341 0.82 NPC1 (0.46) PDPK1PRKDCTLK2JAK3
SCHEMBL24153266 0.82 NPC1 (0.45) ALDH1A1
SCHEMBL24152342 0.81 NPC1 (0.46) ALDH1A1
SCHEMBL24152827 0.81 PRKDC (0.41) PDPK1PRKDCTLK2JAK3MGAT2
SCHEMBL24152344 0.81 KMT2A (0.52) PDPK1PRKDCTLK2JAK3MGAT2
SCHEMBL24152392 0.80 MOGAT2 (0.45) PDPK1CDK2ALDH1A1CTDSP1MGAT2
SCHEMBL24151592 0.78 CDK2 (0.43) PDPK1PRKDCTLK2JAK3CDK2

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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