SCHEMBL19847847

SCHEMBL19847847

C=C(c1cc2c(cc1F)OCC(=O)N2)N1CC(COc2ccc(F)cc2Cl)C1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 16/20 0.62
▸ NR3C2 P08235 2/20 0.44
▸ TP53 P04637 1/20 0.40
▸ PKM P14618 1/20 0.39

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
SCHEMBL19848034 0.92 MGLL (0.52) MGLLNR3C2TP53PKM
SCHEMBL19833794 0.91 MGLL (0.67) MGLLNR3C2
SCHEMBL22386265 0.87 MGLL (0.70) MGLLNR3C2
SCHEMBL19833979 0.86 MGLL (0.66) MGLLNR3C2
SCHEMBL19848040 0.86 MGLL (0.45) MGLLTP53PKM
SCHEMBL19833803 0.85 MGLL (0.79) MGLLNR3C2
SCHEMBL19847964 0.85 MGLL (0.44) MGLLTP53PKM
SCHEMBL19847923 0.85 MGLL (0.66) MGLLNR3C2
SCHEMBL19833877 0.84 MGLL (0.59) MGLLNR3C2
SCHEMBL19833712 0.84 MGLL (0.65) MGLLNR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3279191-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2020-09-02 — — EP disclosed
EP-3279191-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2018-02-07 — — EP disclosed
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