SCHEMBL8312964

SCHEMBL8312964

O=Cc1ccc(OCC2CCC(COc3ccc(C=O)cc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 5/20 0.54
PARP10 Q53GL7 5/20 0.54
PARP2 Q9UGN5 2/20 0.54
HPGD P15428 6/20 0.50
ALDH1A1 P00352 4/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP2A6 P11509 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KDM4E B2RXH2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL8314306 1.00 PARP15 (0.54) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL3718600 1.00 PARP15 (0.54) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL22820830 0.95 PARP15 (0.50) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL6686905 0.94 PARP15 (0.58) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL1299143 0.93 HPGD (0.58) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL1299517 0.92 HPGD (0.61) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL1299658 0.91 HPGD (0.59) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL10906512 0.91 HPGD (0.59) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL3067625 0.90 PARP15 (0.54) PARP15PARP10PARP2HPGDALDH1A1
SCHEMBL28371333 0.88 ALDH1A1 (0.50) PARP15PARP10PARP2HPGDALDH1A1

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 3 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
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