SCHEMBL28257989

SCHEMBL28257989

CC(C)(C)OC(=O)C1(C)CC(=O)CN1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BUB1 O43683 1/20 0.33
GAA P10253 1/20 0.31
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 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
SCHEMBL28535355 0.85
SCHEMBL2048424 0.84 BUB1 (0.33) BUB1DDB1CRBN
SCHEMBL26915679 0.79 BUB1 (0.36) BUB1GAADDB1CRBN
SCHEMBL27219481 0.79 BUB1 (0.36) BUB1GAADDB1CRBN
SCHEMBL17937395 0.79 BUB1 (0.36) BUB1GAADDB1CRBN
SCHEMBL25301908 0.78 BUB1 (0.38) BUB1GAADDB1CRBN
SCHEMBL31456782 0.78 BUB1 (0.38) BUB1GAADDB1CRBN
SCHEMBL350967 0.78 BUB1 (0.38) BUB1GAADDB1CRBN
SCHEMBL23858688 0.78 KDM4E (0.33) GAA
SCHEMBL23858690 0.78 KDM4E (0.33) GAA

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-105658646-B Aminoheteroaryl benzamide as kinase inhibitor 诺华股份有限公司 2018-11-27 CN disclosed