SCHEMBL7907804

SCHEMBL7907804

O=C(O)c1ccc(OCc2ccccc2)cc1OCC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 3/20 0.54
PARP15 Q460N3 2/20 0.54
MAOB P27338 2/20 0.49
C5AR1 P21730 1/20 0.47
FFAR1 O14842 2/20 0.47
PPARD Q03181 2/20 0.47
SGMS2 Q8NHU3 1/20 0.46
MCL1 Q07820 1/20 0.46
NR4A2 P43354 2/20 0.46
NR4A1 P22736 1/20 0.46
NR4A3 Q92570 1/20 0.46
SLC16A3 O15427 1/20 0.46
DGAT1 O75907 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45

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
SCHEMBL7317868 0.95 PARP10 (0.57) PARP10PARP15MAOBC5AR1FFAR1
SCHEMBL7911253 0.89 PARP10 (0.56) PARP10PARP15MAOBC5AR1FFAR1
SCHEMBL7317871 0.83 SGMS2 (0.55) PARP10PARP15SGMS2MEN1KMT2A
SCHEMBL4756552 0.83 MAOB (0.63) MAOBMCL1NR4A2NR4A1NR4A3
SCHEMBL4846094 0.81 C5AR1 (0.47) PARP10PARP15C5AR1FFAR1PPARD
SCHEMBL7322745 0.81 PARP10 (0.53) PARP10PARP15MAOB
SCHEMBL1388095 0.80 FAAH (0.60) PARP10PARP15SGMS2MEN1KMT2A
SCHEMBL21924233 0.80 MAOB (0.60) MAOBMCL1NR4A2NR4A1NR4A3
SCHEMBL7322019 0.80 C5AR1 (0.48) PARP10PARP15C5AR1FFAR1PPARD
SCHEMBL5968109 0.80 SGMS2 (0.55) MAOBSGMS2MEN1KMT2A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0728128-B1 SUBSTITUTED PHENYL COMPOUNDS RHONE POULENC RORER LTD (GB) 1998-09-16 EP claimed
EP-0728128-A1 SUBSTITUTED PHENYL COMPOUNDS RHONE-POULENC RORER LIMITED (GB) 1996-08-28 EP claimed
WO-1995013262-A1 SUBSTITUTED PHENYL COMPOUNDS RHONE-POULENC RORER LIMITED (GB) 1995-05-18 WO claimed
US-RE40558-E1 Therapeutic uses of di-aryl acid derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-10-28 US disclosed
US-RE40558-E1 Therapeutic uses of di-aryl acid derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-10-28 US disclosed
US-6211234-B1 BENZONITRILE COMPOUNDS WITH ETHER AND SULFIDE GROUPS WITH CARBOXY ACID RHONE-POULENC RORER LIMITED (GB) 2001-04-03 US disclosed
EP-0728128-B1 SUBSTITUTED PHENYL COMPOUNDS RHONE POULENC RORER LTD (GB) 1998-09-16 EP disclosed
EP-0728128-A1 SUBSTITUTED PHENYL COMPOUNDS RHONE-POULENC RORER LIMITED (GB) 1996-08-28 EP disclosed
WO-1995013262-A1 SUBSTITUTED PHENYL COMPOUNDS RHONE-POULENC RORER LIMITED (GB) 1995-05-18 WO disclosed