SCHEMBL24151587

SCHEMBL24151587

CCN(C(c1ccccc1)c1ccccc1)S(=O)(=O)c1ccc2c(c1)/C(=C\c1nccs1)C(=O)N2C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.42
▸ MAPT P10636 4/20 0.34
▸ POLB P06746 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ STAT3 P40763 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ SCN1B Q07699 4/20 0.32
▸ SCN8A Q9UQD0 4/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ SCN1A P35498 3/20 0.32
▸ SCN5A Q14524 3/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CASP3 P42574 2/20 0.32
▸ CASP7 P55210 2/20 0.32

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
SCHEMBL24153255 0.92 TRPA1 (0.40) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24152462 0.92 TRPA1 (0.41) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24152464 0.92 TRPA1 (0.41) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24152847 0.91 TRPA1 (0.41) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24152517 0.91 TRPA1 (0.48) TRPA1MAPTPOLBSMN1; SMN2LMNA
SCHEMBL24152461 0.90 TRPA1 (0.40) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24152465 0.90 TRPA1 (0.40) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24153269 0.90 TRPA1 (0.40) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24151584 0.89 TRPA1 (0.42) TRPA1MAPTPOLBSMN1; SMN2STAT3
SCHEMBL24152463 0.88 TRPA1 (0.41) TRPA1MAPTPOLBSMN1; SMN2STAT3

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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