SCHEMBL7910959

SCHEMBL7910959

COC(=O)c1ccc(OCc2cccc3ccccc23)cc1OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 2/20 0.64
▸ PARP15 Q460N3 1/20 0.64
▸ FDPS P14324 1/20 0.53
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ FFAR1 O14842 1/20 0.52
▸ AKR1B1 P15121 1/20 0.52
▸ HIF1A Q16665 1/20 0.48
▸ MAPK8 P45983 1/20 0.48
▸ MAPK9 P45984 1/20 0.48
▸ MAPK10 P53779 1/20 0.48
▸ MAOB P27338 1/20 0.48
▸ EDNRA P25101 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ FFAR4 Q5NUL3 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ RECQL P46063 1/20 0.46

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
SCHEMBL7911320 0.89 PARP10 (0.63) PARP10PARP15FDPSMEN1KMT2A
SCHEMBL12149855 0.89 PARP10 (0.63) PARP10PARP15FDPSMEN1KMT2A
SCHEMBL3962253 0.87 MAOB (0.61) PARP15MEN1KMT2AMAOBNPC1
SCHEMBL7911237 0.85 PARP10 (0.64) PARP10PARP15FDPSMEN1KMT2A
SCHEMBL7908641 0.84 ALOX5 (0.55) MAOBNPC1FFAR4MRGPRX4
SCHEMBL1376902 0.83 PARP10 (0.56) PARP10PARP15FDPSMEN1KMT2A
SCHEMBL7907439 0.82 MAOB (0.56) FFAR1MAOBNPC1RAB9AFFAR4
SCHEMBL21924287 0.82 MAOB (0.58) PARP15MEN1KMT2AMAOBNPC1
SCHEMBL3191667 0.82 MAOB (0.58) PARP10PARP15MEN1KMT2AMAOB
SCHEMBL7910785 0.81 MAOB (0.59) PARP15FFAR1MAOBNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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