SCHEMBL7152169

SCHEMBL7152169

O=C(O)c1ccc(OCc2ccc(F)cc2)c(OCc2ccc(F)cc2)c1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.65
NR4A2 P43354 2/20 0.65
MRGPRX4 Q96LA9 3/20 0.62
RXRA P19793 4/20 0.57
RXRB P28702 3/20 0.57
RXRG P48443 2/20 0.57
PTGER1 P34995 1/20 0.56
PTPN7 P35236 1/20 0.55
PTPN12 Q05209 1/20 0.55
PTPN22 Q9Y2R2 1/20 0.55
XDH P47989 1/20 0.54
HPGD P15428 2/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL5307725 0.91 MRGPRX4 (0.76) PPARANR4A2MRGPRX4RXRAPTPN7
SCHEMBL4428716 0.89 NR4A2 (0.63) PPARANR4A2MRGPRX4RXRARXRB
SCHEMBL29556736 0.85 MRGPRX4 (0.62) NR4A2MRGPRX4RXRARXRBRXRG
SCHEMBL1600077 0.85 MRGPRX4 (0.62) NR4A2MRGPRX4RXRARXRBRXRG
SCHEMBL17916639 0.84 NR4A2 (0.60) PPARANR4A2MRGPRX4RXRARXRB
Hydrochloric Acid SCHEMBL10857748 0.84 MRGPRX4 (0.61) NR4A2MRGPRX4RXRARXRBRXRG
SCHEMBL25216997 0.83 XDH (0.66) PPARANR4A2MRGPRX4PTGER1PTPN7
SCHEMBL7516329 0.82 NR4A2 (0.55) PPARANR4A2MRGPRX4PTGER1NPC1
SCHEMBL7469360 0.82 MRGPRX4 (0.71) PPARAMRGPRX4RXRAPTGER1HPGD
SCHEMBL29556803 0.82 MRGPRX4 (0.71) PPARAMRGPRX4RXRAPTGER1HPGD

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
US-6528655-B1 Hydroxyphenyl diamido derivatives PHARMACOR, INC. (CA) 2003-03-04 US disclosed
WO-2002026697-A2 AROMATIC DERIVATIVES WITH HIV INTEGRASE INHIBITORY PROPERTIES PHARMACOR, INC. (CA) 2002-04-04 WO disclosed