SCHEMBL24152344

SCHEMBL24152344

CCC(CC)NC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)/C(=C\c2nccs2)C(=O)N3)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.52
▸ PRKDC P78527 1/20 0.44
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ TLK2 Q86UE8 5/20 0.41
▸ MGAT2 Q10469 5/20 0.39
▸ PAK4 O96013 3/20 0.39
▸ MGAT1 P26572 2/20 0.39
▸ MGAT3 Q09327 2/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ PDPK1 O15530 1/20 0.39
▸ RXFP1 Q9HBX9 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
SCHEMBL24153254 0.88 TLK2 (0.44) KMT2APRKDCTLK2JAK3PDPK1
SCHEMBL24151549 0.87 RXFP1 (0.49) KMT2APRKDCNPC1RAB9ATLK2
SCHEMBL24151550 0.86 GAA (0.52) KMT2APRKDCTLK2MGAT2JAK3
SCHEMBL24152343 0.85 KMT2A (0.51) KMT2APRKDCNPC1RAB9ATLK2
SCHEMBL24153211 0.85 JAK3 (0.44) KMT2APRKDCTLK2JAK3PDPK1
SCHEMBL24152341 0.84 NPC1 (0.46) PRKDCNPC1RAB9ATLK2JAK3
SCHEMBL24151592 0.83 CDK2 (0.43) PRKDCTLK2JAK3PDPK1
SCHEMBL24152827 0.82 PRKDC (0.41) PRKDCTLK2MGAT2MGAT1JAK3
SCHEMBL24153266 0.81 NPC1 (0.45) KMT2ANPC1RAB9A
SCHEMBL24151582 0.81 PDPK1 (0.43) PRKDCTLK2MGAT2JAK3PDPK1

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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