SCHEMBL22755073

SCHEMBL22755073

Cc1c[nH]c(=O)c2c(C(=O)N3CC4CC4(c4ccc(OC(F)(F)F)c(F)c4)C3)c[nH]c12

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 9/20 0.37
▸ MGLL Q99685 5/20 0.36
▸ SLC6A9 P48067 1/20 0.34
▸ HCRTR1 O43613 1/20 0.33
▸ HCRTR2 O43614 1/20 0.33
▸ HSD11B1 P28845 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
SCHEMBL22754980 0.82 MGLL (0.39) MGLLHCRTR1HCRTR2HSD11B1
SCHEMBL22754886 0.82 MGLL (0.37) MGLL
SCHEMBL22755305 0.81 MGLL (0.42) MGLL
SCHEMBL22755029 0.81 MGLL (0.42) MGLL
SCHEMBL22755296 0.80 MGLL (0.40) MGLLHSD11B1
SCHEMBL22755028 0.80 MGLL (0.36) MGLLHCRTR1HCRTR2HSD11B1
SCHEMBL22754925 0.80 MGLL (0.41) MGLLHSD11B1
SCHEMBL22729525 0.79 MGLL (0.36) PDE2AMGLLSLC6A9HCRTR1HCRTR2
SCHEMBL22754906 0.79 MGLL (0.39) MGLL
SCHEMBL22755286 0.78 MGLL (0.36) 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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