SCHEMBL22755217

SCHEMBL22755217

Cc1c[nH]c(=O)c2c(C(=O)N3CC4CC4(c4cccc(C(F)(F)F)c4)C3)cn(C)c12

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 4/20 0.43
▸ TP53 P04637 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CNR2 P34972 1/20 0.36
▸ DRD2 P14416 3/20 0.35
▸ DRD3 P35462 3/20 0.35
▸ KCNH2 Q12809 3/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CBL P22681 1/20 0.33
▸ CBLB Q13191 1/20 0.33
▸ GRIN2B Q13224 3/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CCR2 P41597 1/20 0.32
▸ SLC6A9 P48067 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
SCHEMBL22755289 0.90 MGLL (0.37) MGLLDRD2DRD3KCNH2CBL
SCHEMBL22754986 0.89 MGLL (0.37) MGLLDRD2DRD3KCNH2
SCHEMBL22755287 0.89 MGLL (0.38) MGLLGRIN2BMEN1KMT2A
SCHEMBL22755233 0.88 MGLL (0.33) MGLL
SCHEMBL22754903 0.88 MGLL (0.37) MGLLTP53MAPTCNR2DRD2
SCHEMBL29839356 0.88 MGLL (0.44) MGLLTP53MAPTDRD2DRD3
SCHEMBL22729616 0.88 MGLL (0.44) MGLLTP53MAPTDRD2DRD3
SCHEMBL22755344 0.84 MGLL (0.47) MGLLKCNH2
SCHEMBL22755282 0.84 DRD3 (0.34) MGLLTP53MAPTDRD3KCNH2
SCHEMBL22755304 0.83 MGLL (0.40) 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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