SCHEMBL22754935

SCHEMBL22754935

Cc1c[nH]c(=O)c2c(C(=O)N3CC4CC4(c4cccs4)C3)cn(C)c12

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 5/20 0.35
▸ SPR P35270 2/20 0.34
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL22729827 0.86 MGLL (0.34) MGLLSPRKMT2A
SCHEMBL22755344 0.84 MGLL (0.47) MGLLSPR
SCHEMBL22755287 0.82 MGLL (0.38) MGLLKMT2A
SCHEMBL22755031 0.82 MGLL (0.35) MGLL
SCHEMBL22755326 0.81 MGLL (0.34) MGLL
SCHEMBL22754903 0.81 MGLL (0.37) MGLLKMT2A
SCHEMBL22754986 0.81 MGLL (0.37) MGLL
SCHEMBL22754902 0.81 SLC6A2 (0.36) MGLLSPRKMT2A
SCHEMBL22755032 0.81 MGLL (0.40) MGLL
SCHEMBL22755295 0.80 MGLL (0.35) MGLL

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
EP-3747885-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2020-12-09 — — EP disclosed
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