SCHEMBL30481233

SCHEMBL30481233

FC(F)(F)c1ccc2c(Br)n[nH]c2c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 4/20 0.55
▸ MAP2K4 P45985 4/20 0.51
▸ MAPK1 P28482 3/20 0.51
▸ MAPK6 Q16659 3/20 0.51
▸ MAPKAPK5 Q8IW41 1/20 0.51
▸ GSK3B P49841 2/20 0.51
▸ KCNQ3 O43525 1/20 0.47
▸ KCNQ2 O43526 1/20 0.47
▸ KCNQ1 P51787 1/20 0.47
▸ SCN5A Q14524 1/20 0.47
▸ KIF11 P52732 7/20 0.46
▸ METAP2 P50579 1/20 0.46
▸ MAPKAPK3 Q16644 2/20 0.45
▸ MAPKAPK2 P49137 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.44
▸ MAPT P10636 1/20 0.41

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
SCHEMBL25279396 1.00 TRPA1 (0.55) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL25241733 0.86 MAP2K4 (0.56) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL30481232 0.86 MAP2K4 (0.56) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL2662677 0.80 TRPA1 (0.56) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL30586177 0.79 TRPA1 (0.55) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL13122227 0.79 TRPA1 (0.55) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL1513093 0.79 TRPA1 (0.55) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL24076862 0.78 MAPT (0.47) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL10220256 0.76 KIF11 (0.56) TRPA1MAP2K4MAPK1MAPK6MAPKAPK5
SCHEMBL30548016 0.76 MAP2K4 (0.56) MAP2K4MAPK1MAPK6MAPKAPK3MAPKAPK2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122060008-A Indazole alkaloid derivative and preparation method and application thereof 江西师范大学 2026-05-19 — — CN disclosed
EP-4452936-A2 INDOLES, INDAZOLES, AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD The Katholieke Universiteit Leuven (BE) 2024-10-30 — — EP disclosed
WO-2023122782-A2 INDOLES, INDAZOLES, AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-06-29 — — WO disclosed
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