SCHEMBL24151586

SCHEMBL24151586

CN(C(c1ccccc1)c1ccccc1)S(=O)(=O)c1ccc2c(c1)/C(=C\c1nccs1)C(=O)N2Cc1ncco1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.47
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ CA9 Q16790 1/20 0.30
▸ CYP1B1 Q16678 1/20 0.30
▸ APP P05067 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ SNCA P37840 1/20 0.30
▸ PRNP P04156 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
SCHEMBL24151764 0.90 TRPA1 (0.49) TRPA1CA12CA1CA2CA9
SCHEMBL24151575 0.89 TRPA1 (0.61) TRPA1CA12CA1CA2CA9
SCHEMBL24152377 0.88 TRPA1 (0.48) TRPA1MAPTPRNP
SCHEMBL24151589 0.85 TRPA1 (0.47) TRPA1CA12CA1CA2CA9
SCHEMBL24151578 0.85 TRPA1 (0.46) TRPA1PRNP
SCHEMBL24151573 0.84 TRPA1 (0.45) TRPA1PRNP
SCHEMBL24151588 0.84 TRPA1 (0.43) TRPA1PRNP
SCHEMBL24151584 0.83 TRPA1 (0.42) TRPA1APPMAPTSNCAPRNP
SCHEMBL24152375 0.82 TRPA1 (0.41) TRPA1MAPTPRNP
SCHEMBL24152517 0.79 TRPA1 (0.48) TRPA1MAPTPRNP

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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