SCHEMBL18616974

SCHEMBL18616974

CCNC(=O)c1cc(C)cnc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
CSNK1D P48730 2/20 0.39
PTGER4 P35408 1/20 0.39
LMNA P02545 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
STAT6 P42226 1/20 0.37
CCNE2 O96020 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
GAA P10253 1/20 0.36
CYP2C19 P33261 1/20 0.36
HPGDS O60760 1/20 0.36
CHIA Q9BZP6 1/20 0.36
KDM1A O60341 1/20 0.36

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
SCHEMBL10174189 0.85 CNR1 (0.42) CNR1CSNK1DPTGER4LMNACA2
SCHEMBL12517203 0.82 CYP1A2 (0.39) CSNK1DLMNACA2CA4CCNE2
SCHEMBL10174188 0.80 LMNA (0.44) CNR1PTGER4LMNACCNE2CCNE1
SCHEMBL20350149 0.77 CSNK1D (0.41) CNR1CSNK1DLMNACA2CA4
SCHEMBL12024794 0.75 PLAT (0.40) CNR1LMNACA2CHIA
SCHEMBL5045651 0.74 CSNK2A1 (0.48) SMN1; SMN2GAAALDH1A1KMT2A
SCHEMBL13926052 0.74 ATM (0.49) LMNACA2GAAALDH1A1
SCHEMBL13753913 0.72 CSNK2A1 (0.56) LMNASMN1; SMN2GAAKMT2A
SCHEMBL12024791 0.72 HCRTR1 (0.55)
SCHEMBL12024793 0.72 CHIA (0.47) LMNACHIA

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-2017037116-A1 PYRIDINONE DICARBOXAMIDE FOR USE AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-03-09 WO disclosed