SCHEMBL8311310

SCHEMBL8311310

Cc1nccc(N2CCC(C(=O)N3CCCN(C(=O)OC(C)(C)C)CC3)C2)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.51
LSS P48449 1/20 0.50
HPGD P15428 1/20 0.49
CKS1B P61024 2/20 0.46
SKP1 P63208 2/20 0.46
SKP2 Q13309 2/20 0.46
PDE10A Q9Y233 1/20 0.45
DGAT2 Q96PD7 3/20 0.43
GPBAR1 Q8TDU6 1/20 0.42
RECQL P46063 1/20 0.42
EIF2AK4 Q9P2K8 1/20 0.42

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
SCHEMBL7165667 0.82 GPR119 (0.71) GPR119LSSHPGDCKS1BSKP1
SCHEMBL3486872 0.81 GPR119 (0.73) GPR119LSS
SCHEMBL8446403 0.80 LSS (0.51) LSSDGAT2GPBAR1EIF2AK4
SCHEMBL8289982 0.80 LSS (0.65) LSSHPGDCKS1BSKP1SKP2
SCHEMBL6975264 0.79 GPR119 (0.54) GPR119CKS1BSKP1SKP2
SCHEMBL7650536 0.78 GPR119 (0.55) GPR119LSSCKS1BSKP1SKP2
SCHEMBL8310078 0.76 LSS (0.83) LSSHPGD
SCHEMBL6981587 0.75 GPR119 (0.59) GPR119HPGDCKS1BSKP1SKP2
SCHEMBL17637739 0.75 GPBAR1 (0.51) LSSHPGDGPBAR1
SCHEMBL7654759 0.74 GPR119 (0.55) GPR119CKS1BSKP1SKP2

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
EP-0925286-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ZENECA LIMITED (GB) 1999-06-30 EP disclosed
WO-1998006705-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ZENECA LIMITED (GB) 1998-02-19 WO disclosed