SCHEMBL7911320

SCHEMBL7911320

O=C(O)c1ccc(OCc2cccc3ccccc23)cc1OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 2/20 0.63
▸ PARP15 Q460N3 1/20 0.63
▸ FDPS P14324 1/20 0.59
▸ FFAR1 O14842 1/20 0.56
▸ AKR1B1 P15121 1/20 0.56
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ MRGPRX4 Q96LA9 2/20 0.52
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ MCL1 Q07820 1/20 0.49
▸ MAOB P27338 1/20 0.49
▸ NR4A2 P43354 1/20 0.49
▸ SLC16A3 O15427 1/20 0.48
▸ ALOX5 P09917 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ MDH2 P40926 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL12149855 1.00 PARP10 (0.63) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL7910959 0.89 PARP10 (0.64) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL1374583 0.88 PARP10 (0.60) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL1378293 0.87 FDPS (0.61) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL12149861 0.86 PARP10 (0.67) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL4756552 0.85 MAOB (0.63) MEN1KMT2AMCL1MAOBNR4A2
SCHEMBL12149845 0.84 MEN1 (0.60) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL12149851 0.83 FDPS (0.57) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL12149854 0.83 PARP10 (0.57) PARP10PARP15FDPSFFAR1AKR1B1
SCHEMBL12149578 0.82 FDPS (0.64) PARP10PARP15FDPSFFAR1AKR1B1

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 7 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-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
Send feedback