SCHEMBL24152847

SCHEMBL24152847

CN1C(=O)/C(=C/c2nccs2)c2cc(S(=O)(=O)N(Cc3nccs3)C(c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.41
▸ LMNA P02545 1/20 0.33
▸ 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
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SCN1B Q07699 1/20 0.31
▸ SCN8A Q9UQD0 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ BRD4 O60885 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
SCHEMBL24151587 0.91 TRPA1 (0.42) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24153249 0.90 TRPA1 (0.41) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24152359 0.90 TRPA1 (0.50) TRPA1PTGS1PTGS2CASP3CASP7
SCHEMBL24152464 0.89 TRPA1 (0.41) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24152462 0.89 TRPA1 (0.41) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24152830 0.88 TRPA1 (0.38) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24153255 0.88 TRPA1 (0.40) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24152461 0.88 TRPA1 (0.40) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24152465 0.87 TRPA1 (0.40) TRPA1LMNAPOLBMAPTSTAT3
SCHEMBL24151584 0.87 TRPA1 (0.42) TRPA1LMNAPOLBMAPTSTAT3

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
Send feedback