SCHEMBL21397261

SCHEMBL21397261

CC(C)(C)OC(=O)NC1CCN(c2ccc(Cl)c(F)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SUV39H2 Q9H5I1 7/20 0.51
DRD2 P14416 3/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
DRD3 P35462 1/20 0.46
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 1/20 0.46
KDM4D Q6B0I6 2/20 0.46
NPY5R Q15761 2/20 0.46
USP14 P54578 1/20 0.44
ATF4 P18848 1/20 0.43

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
SCHEMBL27655935 0.90 SUV39H2 (0.54) SUV39H2DRD2CNR1CNR2DRD3
SCHEMBL7521871 0.85 SUV39H2 (0.51) SUV39H2DRD2CNR1CNR2DRD3
SCHEMBL13466335 0.84 PIM1 (0.45) SUV39H2CNR1CNR2CKS1BSKP1
SCHEMBL5220499 0.84 KDM4D (0.53) SUV39H2DRD2CKS1BSKP1SKP2
SCHEMBL3108407 0.83 CNR1 (0.55) SUV39H2DRD2CNR1CNR2DRD3
SCHEMBL5216885 0.83 CHRM4 (0.53) SUV39H2DRD2CKS1BSKP1SKP2
SCHEMBL1350092 0.83 SUV39H2 (0.49) SUV39H2CKS1BSKP1SKP2KDM4D
SCHEMBL1350090 0.83 SUV39H2 (0.49) SUV39H2CKS1BSKP1SKP2KDM4D
SCHEMBL14301964 0.82 CKS1B (0.46) SUV39H2DRD2CKS1BSKP1SKP2
SCHEMBL25453973 0.82 SUV39H2 (0.50) SUV39H2DRD2CNR1CNR2DRD3

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
WO-2019179362-A1 AMIDINE AND GUANIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICAL USES THEREOF 四川科伦博泰生物医药股份有限公司 2019-09-26 WO disclosed