SCHEMBL29029079

SCHEMBL29029079

CC(C)(C)OC(=O)N1C=CNC=C1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BCHE P06276 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
MAPK1 P28482 1/20 0.33
CTSK P43235 1/20 0.33
NR1H2 P55055 2/20 0.32
HPGD P15428 1/20 0.31
FAAH O00519 1/20 0.31
GPR119 Q8TDV5 1/20 0.30
PREP P48147 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
SCHEMBL29250309 0.84 USP2 (0.42) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL5773612 0.78 USP2 (0.38) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL5858067 0.75 USP2 (0.40) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL27771573 0.75 BCHE (0.39) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL3354765 0.75 USP2 (0.40) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL29056833 0.71 USP2 (0.33) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL28026573 0.69 BCHE (0.35) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL29056822 0.68 BCHE (0.34) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL1615448 0.68 USP2 (0.32) USP2SMN1; SMN2BCHECHRM2CHRM1
SCHEMBL28034490 0.68 USP2 (0.34) USP2SMN1; SMN2BCHECHRM2CHRM1

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-116368128-A Heterocyclic compounds as CBP/EP300 bromodomain inhibitors 奥瑞基尼肿瘤有限公司 2023-06-30 CN disclosed