SCHEMBL22755016

SCHEMBL22755016

Cc1c[nH]c(=O)c2c(C(=O)N3CC4CC4(c4cc(Cl)ccc4Cl)C3)cn(C)c12

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ MGLL Q99685 3/20 0.34
▸ TP53 P04637 3/20 0.32
▸ LMNA P02545 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ PROKR1 Q8TCW9 1/20 0.32
▸ AVPR1A P37288 2/20 0.31
▸ P2RX7 Q99572 1/20 0.30

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
SCHEMBL22755304 0.87 MGLL (0.40) MGLL
SCHEMBL22729457 0.87 TSHR (0.39) TSHRALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL29839371 0.87 TSHR (0.39) TSHRALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22755326 0.86 MGLL (0.34) MGLLP2RX7
SCHEMBL22754903 0.86 MGLL (0.37) TSHRALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22755295 0.86 MGLL (0.35) TSHRALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22755344 0.83 MGLL (0.47) MGLL
SCHEMBL22755031 0.83 MGLL (0.35) MGLL
SCHEMBL22754902 0.81 SLC6A2 (0.36) TSHRALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22755287 0.81 MGLL (0.38) 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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