SCHEMBL10184095

SCHEMBL10184095

CC(C)(C)OC(=O)N1CCC(N2C(=O)C(N(C(=O)Cc3cccs3)c3cccc(F)c3)c3ccccc32)C1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.41
▸ GPR119 Q8TDV5 3/20 0.37
▸ USP30 Q70CQ3 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ JAK2 O60674 1/20 0.35
▸ JAK1 P23458 1/20 0.35
▸ LMNA P02545 3/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ SCN5A Q14524 1/20 0.33
▸ SCN9A Q15858 1/20 0.33

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
SCHEMBL10185544 0.84 OPRM1 (0.40) TP53LMNAOPRM1OPRD1OPRK1
SCHEMBL10185926 0.83 OPRM1 (0.39) TP53LMNAOPRM1OPRD1OPRK1
SCHEMBL10183666 0.83 OPRM1 (0.39) TP53LMNAOPRM1OPRD1OPRK1
SCHEMBL10183767 0.82 OPRM1 (0.39) OPRM1OPRD1OPRK1
SCHEMBL10183314 0.77 CCKBR (0.37) OPRM1OPRD1OPRK1
SCHEMBL10185945 0.75 OPRM1 (0.39) TP53OPRM1OPRD1OPRK1
SCHEMBL10183904 0.74 OPRM1 (0.38) OPRM1OPRD1OPRK1
SCHEMBL10184154 0.74 POLB (0.39) MEN1KMT2AOPRM1OPRD1OPRK1
SCHEMBL10184153 0.74 OPRM1 (0.39) OPRM1OPRD1OPRK1
SCHEMBL10183975 0.73 POLB (0.37) TP53MEN1KMT2AOPRM1OPRD1

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
WO-2012009678-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHOD OF USE AGIOS PHARMACEUTICALS, INC. (US) 2012-01-19 — — WO disclosed
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