SCHEMBL8310764

SCHEMBL8310764

O=C1NC(=O)C(Cc2ccc(OC[C@H]3CC[C@H](COc4ccc(CC5OC(=O)NC5=O)cc4)CC3)cc2)O1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 5/20 0.45
PARP10 Q53GL7 5/20 0.45
BRD4 O60885 1/20 0.42
CREBBP Q92793 1/20 0.42
PARP2 Q9UGN5 1/20 0.41
GRM2 Q14416 3/20 0.41
HTT P42858 1/20 0.40
HPGD P15428 5/20 0.40
GAA P10253 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL8310766 1.00 PARP15 (0.45) PARP15PARP10BRD4CREBBPPARP2
SCHEMBL8315754 0.83 FFAR1 (0.48) PARP10GRM2HTTGAAPOLB
SCHEMBL8312946 0.81 CYP4F2 (0.39) BRD4HTTGAAPOLBKMT2A
SCHEMBL12521895 0.81 CTSK (0.46) PARP10GAAPOLBKMT2AMAOA
SCHEMBL8189509 0.81 GAA (0.53) HTTGAAPOLBKMT2AMAOA
SCHEMBL7987732 0.78 MEN1 (0.49) GRM2HPGDPOLBKMT2AMAOA
SCHEMBL9570642 0.78 LMNA (0.51) GAAPOLBKMT2A
SCHEMBL12521787 0.77 HPGD (0.60) HTTHPGDGAAPOLBKMT2A
SCHEMBL8310735 0.76 FURIN (0.39) PARP10GRM2HTTHPGD
SCHEMBL8181635 0.76 CA2 (0.41) BRD4KMT2AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0597102-B1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF AND HYPOGLYCEMIC COMPOSITION YAMANOUCHI PHARMA CO LTD (JP) 1999-01-07 EP claimed
EP-0597102-A1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1994-05-18 EP claimed
EP-0597102-B1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF AND HYPOGLYCEMIC COMPOSITION YAMANOUCHI PHARMA CO LTD (JP) 1999-01-07 EP disclosed
US-5508296-A HYPOGLYCEMIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1996-04-16 US disclosed
EP-0597102-A1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1994-05-18 EP disclosed