SCHEMBL14865458

SCHEMBL14865458

CCc1cc(C(=O)NC2(C(=O)O)CCC(C)(C)CC2)c(=O)n(CCOC)c1CCC(C)C

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.50
CNR1 P21554 9/20 0.40
CXCR2 P25025 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ATM Q13315 1/20 0.31
SLC18A2 Q05940 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
SCHEMBL5523176 0.91 CNR2 (0.58) CNR2CNR1
SCHEMBL14679047 0.81 CNR2 (0.61) CNR2CNR1
SCHEMBL5517425 0.81 CNR2 (0.67) CNR2CNR1CXCR2
SCHEMBL5517414 0.81 CNR2 (0.65) CNR2CNR1ATM
SCHEMBL11922999 0.78 CNR2 (0.46) CNR2CNR1LMNA
SCHEMBL5518920 0.73 CNR2 (0.83) CNR2CNR1
SCHEMBL5525261 0.73 CNR2 (0.83) CNR2CNR1
SCHEMBL5521598 0.73 CNR2 (0.83) CNR2CNR1
SCHEMBL2746591 0.73 CNR2 (0.83) CNR2CNR1
SCHEMBL14679043 0.73 CNR2 (0.83) CNR2CNR1

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
EP-1806342-B1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO (JP) 2013-04-17 EP disclosed