SCHEMBL24152465

SCHEMBL24152465

CN1C(=O)/C(=C/c2nccs2)c2cc(S(=O)(=O)N(CC3CC3)C(c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.40
▸ CASP3 P42574 4/20 0.34
▸ CASP7 P55210 4/20 0.34
▸ LMNA P02545 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SCN8A Q9UQD0 2/20 0.32
▸ SCN1B Q07699 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ STAT3 P40763 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CASP1 P29466 1/20 0.30
▸ CASP6 P55212 1/20 0.30
▸ SCN1A P35498 1/20 0.30
▸ SCN5A Q14524 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
SCHEMBL24152839 0.93 TRPA1 (0.38) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24151587 0.90 TRPA1 (0.42) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24152462 0.88 TRPA1 (0.41) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24152464 0.88 TRPA1 (0.41) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24152847 0.87 TRPA1 (0.41) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24152360 0.87 TRPA1 (0.43) TRPA1CASP3
SCHEMBL24152461 0.87 TRPA1 (0.40) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24153255 0.87 TRPA1 (0.40) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24153269 0.86 TRPA1 (0.40) TRPA1CASP3CASP7LMNAMEN1
SCHEMBL24151584 0.85 TRPA1 (0.42) TRPA1CASP3CASP7LMNAMEN1

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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