Sugi Predict

Sugi Predict / Compounds / SCHEMBL24152515

SCHEMBL24152515

SCHEMBL24152515

CC(Cc1cnc(/C=C2/C(=O)N(CC3CC3)c3ccc(S(=O)(=O)N(CC4CC4)C(c4ccccc4)c4ccccc4)cc32)s1)N1C(=O)/C(=C/c2nccs2)c2cc(S(=O)(=O)N(C(C)C)C(c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.35

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
SCHEMBL24152360 0.84 TRPA1 (0.43) TRPA1
SCHEMBL24152363 0.81 TRPA1 (0.43) TRPA1
SCHEMBL24151573 0.80 TRPA1 (0.45) TRPA1
SCHEMBL24152465 0.80 TRPA1 (0.40) TRPA1
SCHEMBL24152839 0.75 TRPA1 (0.38) TRPA1
SCHEMBL24151588 0.75 TRPA1 (0.43) TRPA1
SCHEMBL24152463 0.74 TRPA1 (0.41) TRPA1
SCHEMBL24152517 0.74 TRPA1 (0.48) TRPA1
SCHEMBL24152372 0.73 TRPA1 (0.47) TRPA1
SCHEMBL24152359 0.72 TRPA1 (0.50) TRPA1

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