SCHEMBL28520055

SCHEMBL28520055

CC(C)(C)OC(=O)C1CN(c2ncc3c(n2)CCN(C(=O)O)C3)CCN1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
HSP90AB1 P08238 6/20 0.42
HSP90AA1 P07900 6/20 0.40
OGA O60502 1/20 0.36
ENPP2 Q13822 1/20 0.36
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 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
SCHEMBL30405653 1.00 MAPT (0.54) MAPTHSP90AB1HSP90AA1OGAENPP2
SCHEMBL28561723 1.00 MAPT (0.54) MAPTHSP90AB1HSP90AA1OGAENPP2
SCHEMBL21528045 0.93 MAPT (0.64) MAPTHSP90AB1HSP90AA1OGADDB1
SCHEMBL21528046 0.93 MAPT (0.64) MAPTHSP90AB1HSP90AA1OGADDB1
SCHEMBL29669795 0.93 MAPT (0.64) MAPTHSP90AB1HSP90AA1OGADDB1
SCHEMBL30805547 0.93 MAPT (0.64) MAPTHSP90AB1HSP90AA1OGADDB1
SCHEMBL21528067 0.87 MAPT (0.64) MAPTHSP90AB1HSP90AA1DDB1CRBN
SCHEMBL21528108 0.87 MAPT (0.64) MAPTHSP90AB1HSP90AA1DDB1CRBN
SCHEMBL25678377 0.85 MAPT (0.44) MAPTHSP90AB1HSP90AA1DDB1CRBN
SCHEMBL25678394 0.85 MAPT (0.44) MAPTHSP90AB1HSP90AA1DDB1CRBN

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
CN-112368289-B C26-linked rapamycin analogues as MTOR inhibitors 锐新医药公司 2024-02-20 CN disclosed
CN-112368289-A C26-linked rapamycin analogs as MTOR inhibitors 锐新医药公司 2021-02-12 CN disclosed