SCHEMBL24151756

SCHEMBL24151756

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SCN8A Q9UQD0 10/20 0.39
▸ SCN1B Q07699 7/20 0.39
▸ LMNA P02545 2/20 0.38
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ STAT3 P40763 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ SCN1A P35498 7/20 0.35
▸ SCN5A Q14524 7/20 0.35
▸ SCN9A Q15858 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ BRD4 O60885 1/20 0.34
▸ SCN4A P35499 1/20 0.34
▸ SCN2A Q99250 1/20 0.34
▸ SCN3A Q9NY46 1/20 0.34
▸ SCN10A Q9Y5Y9 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL24151584 0.83 TRPA1 (0.42) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24152463 0.82 TRPA1 (0.41) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24152367 0.82 TRPA1 (0.41) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24151587 0.81 TRPA1 (0.42) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24151583 0.80 CDK2 (0.42) MEN1KMT2AALDH1A1
SCHEMBL24152464 0.79 TRPA1 (0.41) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24152462 0.79 TRPA1 (0.41) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24152847 0.79 TRPA1 (0.41) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24153255 0.78 TRPA1 (0.40) TRPA1MEN1KMT2ASCN8ASCN1B
SCHEMBL24152461 0.78 TRPA1 (0.40) TRPA1MEN1KMT2ASCN8ASCN1B

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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