SCHEMBL31944

SCHEMBL31944

COc1ccc(CN2CC(=O)NC2=O)cc1C(=O)NCc1ccc(Oc2ccc(C(N)=O)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.47
PPARG P37231 4/20 0.47
PPARD Q03181 3/20 0.47
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PDE4A P27815 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
NR1H4 Q96RI1 1/20 0.41
PTGER4 P35408 1/20 0.41
PTGER2 P43116 1/20 0.41
MAPT P10636 1/20 0.41
MMP2 P08253 1/20 0.41
MMP13 P45452 1/20 0.41
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
KLKB1 P03952 1/20 0.40

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
SCHEMBL31881 0.92 PTGER4 (0.51) PPARAPPARGPPARDNR1H4PTGER4
SCHEMBL31948 0.89 PPARA (0.58) PPARAPPARGPPARDPTGER4PTGER2
SCHEMBL12636567 0.83 PPARA (0.48) PPARAPPARGPPARDHDAC1HDAC6
SCHEMBL31929 0.81 PDE4A (0.44) PPARAPPARGPPARDPDE4APDE4B
SCHEMBL31932 0.80 PDE4A (0.44) PPARAPPARGPPARDPDE4APDE4B
SCHEMBL31970 0.79 PDE4A (0.43) PPARAPPARGPPARDPDE4APDE4B
SCHEMBL31947 0.77 LMNA (0.44) MAPT
SCHEMBL31942 0.76 PTGER4 (0.47) PPARAPPARGPPARDHDAC6PDE4A
SCHEMBL31703 0.75 MRGPRX4 (0.47) MAPT
SCHEMBL12636568 0.75 PTGER4 (0.52) PPARAPPARGPPARDNR1H4PTGER4

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-2012026495-A1 NOVEL HYDANTOIN DERIVATIVE AND MEDICINAL AGENT COMPRISING SAME AS ACTIVE INGREDIENT 杏林製薬株式会社 (JP) 2012-03-01 WO disclosed