SCHEMBL28139552

SCHEMBL28139552

CC(C)(C)OC(=O)NCCn1ccc2cnc(Cl)nc21

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.52
STK17A Q9UEE5 1/20 0.52
MTNR1A P48039 4/20 0.44
MTNR1B P49286 3/20 0.44
CKS1B P61024 1/20 0.43
SKP1 P63208 1/20 0.43
SKP2 Q13309 1/20 0.43
DRD2 P14416 7/20 0.43
ABL1 P00519 1/20 0.39
PDGFRB P09619 1/20 0.39
SRC P12931 1/20 0.39
PDGFRA P16234 1/20 0.39
MAPK14 Q16539 1/20 0.39
BRD4 O60885 1/20 0.38
IDO1 P14902 1/20 0.38

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
Methylene Chloride SCHEMBL28101723 0.98 STK17B (0.50) STK17BSTK17AMTNR1AMTNR1BCKS1B
SCHEMBL24110648 0.83 MTNR1A (0.46) STK17BSTK17AMTNR1AMTNR1BCKS1B
SCHEMBL31637422 0.81 BRD4 (0.44) STK17BSTK17AMTNR1AMTNR1BDRD2
SCHEMBL27156693 0.81 STK17B (0.53) STK17BSTK17ACKS1BSKP1SKP2
SCHEMBL28953978 0.80 STK17B (0.47) STK17BSTK17ACKS1BSKP1SKP2
SCHEMBL21268786 0.79 MTNR1A (0.54) MTNR1AMTNR1BCKS1BSKP1SKP2
SCHEMBL28175138 0.78 STK17B (0.44) STK17BSTK17ACKS1BSKP1SKP2
SCHEMBL24110645 0.78 MTNR1A (0.47) MTNR1AMTNR1BDRD2BRD4
SCHEMBL24669199 0.77 DRD2 (0.43) STK17BSTK17AMTNR1ADRD2
SCHEMBL29437373 0.77 STK17B (0.49) STK17BSTK17ACKS1BSKP1SKP2

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-103936745-B Cdk inhibitors G1治疗公司 2017-04-12 CN disclosed