SCHEMBL6472836

SCHEMBL6472836

O=C(O)c1ccc(Cc2c[nH]c(=O)c(Br)c2OCc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.47
NR4A2 P43354 1/20 0.47
NR4A3 Q92570 1/20 0.47
RXRA P19793 5/20 0.45
RXRB P28702 4/20 0.45
RXRG P48443 2/20 0.45
SRD5A2 P31213 2/20 0.44
PTGER1 P34995 1/20 0.44
PTGER4 P35408 1/20 0.44
PTGER3 P43115 1/20 0.44
PTGER2 P43116 1/20 0.44
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 1/20 0.42
PLA2G4B P0C869 1/20 0.42
DPYD Q12882 1/20 0.41
PNP P00491 1/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL6472151 0.91 PARP10 (0.49) DPYDPNPHDAC1HDAC6
SCHEMBL6472682 0.89 LMNA (0.49) TSHRSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL6652475 0.88 DPYD (0.41) RXRARXRBRXRGPTGER1PTGER4
SCHEMBL6647198 0.86 PNP (0.40) SMN1; SMN2HPGDDPYDPNPHDAC1
SCHEMBL6472152 0.83 MAOB (0.47) SMN1; SMN2DPYDPNP
SCHEMBL6648876 0.82 RXRA (0.48) NR4A1NR4A2NR4A3RXRARXRB
SCHEMBL6471484 0.82 DPYD (0.46) NR4A2PTGER1SMN1; SMN2MEN1KMT2A
SCHEMBL6471088 0.82 THRA (0.45) PTGER1PTGER4PTGER3PTGER2TSHR
SCHEMBL6473794 0.81 SIRT2 (0.40) TSHRSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL6652195 0.80 MAPK14 (0.38) SMN1; SMN2KMT2ADPYDPNP

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-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed