SCHEMBL8115281

SCHEMBL8115281

O=c1[nH]ncc2cc[c]cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
HSD17B10 Q99714 3/20 0.56
TDP1 Q9NUW8 3/20 0.56
PARP1 P09874 1/20 0.56
PRKCI P41743 1/20 0.56
PDE4B Q07343 1/20 0.56
MAPK1 P28482 3/20 0.35
KDM4E B2RXH2 4/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
XDH P47989 2/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
ADORA2A P29274 1/20 0.34
SLC6A4 P31645 1/20 0.34
ADRA1A P35348 1/20 0.34
BLM P54132 1/20 0.34
SLC2A1 P11166 1/20 0.33
CYP1A2 P05177 1/20 0.32

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
SCHEMBL8115175 0.85 ALDH1A1 (0.56) ALDH1A1HSD17B10TDP1PARP1PRKCI
Phthalazinone SCHEMBL28316930 0.75 PARP1 (0.96) ALDH1A1HSD17B10TDP1PARP1PRKCI
Phthalazinone SCHEMBL51553 0.72 PARP1 (1.00) ALDH1A1HSD17B10TDP1PARP1PRKCI
SCHEMBL23442 0.72
Phthalazinone SCHEMBL11519244 0.71 PARP1 (0.96) ALDH1A1HSD17B10TDP1PARP1PRKCI
Phthalazinone SCHEMBL2962226 0.71 PARP1 (0.96) ALDH1A1HSD17B10TDP1PARP1PRKCI
Phthalazinone SCHEMBL11516875 0.71 PARP1 (0.96) ALDH1A1HSD17B10TDP1PARP1PRKCI
Phthalazinone SCHEMBL2473799 0.71 PARP1 (0.96) ALDH1A1HSD17B10TDP1PARP1PRKCI
Phthalazinone SCHEMBL11690359 0.71 PARP1 (0.96) ALDH1A1HSD17B10TDP1PARP1PRKCI
Phthalazinone SCHEMBL11516881 0.71 PARP1 (0.96) ALDH1A1HSD17B10TDP1PARP1PRKCI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0751944-B1 THIAZOLIDINES AND OXAZOLIDINES SUBSTITUTED BY A PYRIDINE RING AND THEIR USE AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL IND LTD (JP) 2000-12-20 EP claimed
US-5955481-A Pyridine type thiazolidines NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-21 US claimed
EP-0751944-A1 THIAZOLIDINES AND OXAZOLIDINES SUBSTITUTED BY A PYRIDINE RING AND THEIR USE AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1997-01-08 EP claimed
WO-1995026347-A1 THIAZOLIDINES AND OXAZOLIDINES SUBSTITUTED BY A PYRIDINE RING AND THEIR USE AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-05 WO claimed
EP-0751944-B1 THIAZOLIDINES AND OXAZOLIDINES SUBSTITUTED BY A PYRIDINE RING AND THEIR USE AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL IND LTD (JP) 2000-12-20 EP disclosed
WO-1999065881-A1 HETEROCYCLIC COMPOUNDS AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1999-12-23 WO disclosed
US-5955481-A Pyridine type thiazolidines NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-21 US disclosed
EP-0751944-A1 THIAZOLIDINES AND OXAZOLIDINES SUBSTITUTED BY A PYRIDINE RING AND THEIR USE AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1997-01-08 EP disclosed
WO-1996026207-A1 THIAZOLIDINE AND OXAZOLIDINE INDOLES WITH HYPOCLYCEMIC ACTIVITY NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1996-08-29 WO disclosed
WO-1996011196-A1 PYRAZOLYLMETHYL-THIAZOLIDINES USEFUL AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1996-04-18 WO disclosed
WO-1995026347-A1 THIAZOLIDINES AND OXAZOLIDINES SUBSTITUTED BY A PYRIDINE RING AND THEIR USE AS HYPOGLYCEMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-05 WO disclosed