SCHEMBL24153263

SCHEMBL24153263

CN1C(=O)/C(=C/c2nccs2)c2cc(S(=O)(=O)N(C)C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.38
▸ BRD4 O60885 4/20 0.35
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ KDR P35968 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ FFAR2 O15552 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ PKM P14618 1/20 0.31
▸ PDE4A P27815 1/20 0.31
▸ PDE4B Q07343 1/20 0.31
▸ PDE4C Q08493 1/20 0.31
▸ PDE4D Q08499 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ STAT3 P40763 1/20 0.31
▸ NR1H2 P55055 1/20 0.31
▸ PRNP P04156 1/20 0.30
▸ CA4 P22748 1/20 0.30
▸ CA7 P43166 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
SCHEMBL24153262 0.93 TRPA1 (0.36) TRPA1CA1CA2SMN1; SMN2POLB
SCHEMBL24151584 0.92 TRPA1 (0.42) TRPA1LMNASMN1; SMN2POLBMAPT
SCHEMBL24153260 0.87 TRPA1 (0.36) TRPA1CA1CA2SMN1; SMN2POLB
SCHEMBL24152367 0.84 TRPA1 (0.41) TRPA1LMNASMN1; SMN2POLBMAPT
SCHEMBL24152463 0.82 TRPA1 (0.41) TRPA1LMNASMN1; SMN2POLBMAPT
SCHEMBL24152375 0.82 TRPA1 (0.41) TRPA1LMNASMN1; SMN2MAPTNR1H2
SCHEMBL24151575 0.81 TRPA1 (0.61) TRPA1CA1CA2MAPT
SCHEMBL24151587 0.81 TRPA1 (0.42) TRPA1LMNASMN1; SMN2POLBMAPT
SCHEMBL24152377 0.81 TRPA1 (0.48) TRPA1LMNASMN1; SMN2PKMPOLB
SCHEMBL24152848 0.80 MAPT (0.46) BRD4CA1CA2SMN1; SMN2PDE4A

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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