SCHEMBL8315554

SCHEMBL8315554

ClCc1ccc(OC[C@H]2CC[C@H](COc3ccc(CCl)cc3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 3/20 0.51
PARP10 Q53GL7 3/20 0.51
PARP2 Q9UGN5 2/20 0.51
TDP1 Q9NUW8 1/20 0.46
SIGMAR1 Q99720 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
SCHEMBL1391126 1.00 PARP15 (0.51) PARP15PARP10PARP2TDP1SIGMAR1
SCHEMBL8315556 1.00 PARP15 (0.51) PARP15PARP10PARP2TDP1SIGMAR1
SCHEMBL26961763 0.88 ACACB (0.48) PARP15PARP10PARP2TDP1
SCHEMBL29024848 0.85 PARP15 (0.64) PARP15PARP10PARP2TDP1SIGMAR1
SCHEMBL16902879 0.80 PARP15 (0.56) PARP15PARP10PARP2TDP1SIGMAR1
SCHEMBL8273728 0.80 PARP15 (0.51) PARP15PARP10PARP2TDP1
SCHEMBL20766456 0.80 PARP15 (0.56) PARP15PARP10PARP2TDP1
SCHEMBL3720802 0.80 PARP15 (0.51) PARP15PARP10PARP2TDP1SIGMAR1
SCHEMBL20421066 0.80 PARP15 (0.46) PARP15PARP10PARP2
SCHEMBL4525743 0.80 PARP15 (0.56) PARP15PARP10PARP2TDP1SIGMAR1

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 6 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 disclosed
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
US-5508296-A HYPOGLYCEMIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1996-04-16 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed
EP-0597102-A1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1994-05-18 EP disclosed