SCHEMBL29237201

SCHEMBL29237201

Cc1c(Oc2ccc(F)c(C(=O)NN)c2)c(F)cc2[nH]ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 2/20 0.36
▸ THRA P10827 3/20 0.35
▸ THRB P10828 3/20 0.35
▸ KDR P35968 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ P2RX7 Q99572 2/20 0.34
▸ BRAF P15056 1/20 0.33
▸ SCN8A Q9UQD0 2/20 0.33
▸ SCN10A Q9Y5Y9 2/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ KAT6A Q92794 1/20 0.33
▸ PRKAB2 O43741 1/20 0.33
▸ PRKAG1 P54619 1/20 0.33
▸ PRKAA2 P54646 1/20 0.33
▸ PRKAA1 Q13131 1/20 0.33
▸ PRKAG3 Q9UGI9 1/20 0.33
▸ PRKAG2 Q9UGJ0 1/20 0.33
▸ PRKAB1 Q9Y478 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ GAA P10253 1/20 0.32

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
SCHEMBL30217386 1.00 SCN9A (0.36) SCN9ATHRATHRBKDRTRPA1
SCHEMBL30967808 0.88 TRPA1 (0.34) SCN9ATHRATHRBKDRTRPA1
SCHEMBL29237596 0.88 TRPA1 (0.34) SCN9ATHRATHRBKDRTRPA1
SCHEMBL27275536 0.87 NR4A2 (0.39) THRATHRBTRPA1SCN8ASCN10A
SCHEMBL31108604 0.87 NR4A2 (0.39) THRATHRBTRPA1SCN8ASCN10A
SCHEMBL30217071 0.83 TRPA1 (0.34) TRPA1PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL29237459 0.83 TRPA1 (0.34) TRPA1PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL27275532 0.77 RHEB (0.42) TRPA1PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL31108517 0.77 RHEB (0.42) TRPA1PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL31108631 0.76 NR4A2 (0.39) SCN9ATHRATHRBTRPA1SCN8A

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
CN-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 — — CN disclosed
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