SCHEMBL31027446

SCHEMBL31027446

CC(C)(C)OC(=O)N1CCC2(CC1)CNC2c1ncnc2ncc(C=O)cc12

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 15/20 0.41
▸ GPR119 Q8TDV5 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ ACACB O00763 3/20 0.35

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
SCHEMBL31027396 0.88 NAMPT (0.41) NAMPTGPR119ACACB
SCHEMBL31027436 0.85 NAMPT (0.41) NAMPTCYP2C9ACACB
SCHEMBL25228458 0.76 KIT (0.44) NAMPTGPR119ACACB
SCHEMBL31027424 0.75 OPRD1 (0.41) NAMPTGPR119
SCHEMBL31027427 0.74 NAMPT (0.49) NAMPTGPR119CYP2C9
SCHEMBL25272218 0.69 KIT (0.45) NAMPTGPR119ACACB
SCHEMBL8218920 0.68 GPR119 (0.48) NAMPTGPR119
SCHEMBL30901891 0.68 NAMPT (0.37) NAMPTGPR119CYP2C9ACACB
SCHEMBL30901894 0.67 MEN1 (0.38) NAMPT
SCHEMBL25277206 0.67 — —

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
CN-118647378-A Inhibitors of Mei Nen protein interaction with MLL 巴拉疗法公司 2024-09-13 — — CN disclosed
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