SCHEMBL8907689

SCHEMBL8907689

O=c1[nH]c2c([nH]c1=O)C(O)c1ccccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 3/20 0.36
KDM4E B2RXH2 2/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
APAF1 O14727 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
PAX8 Q06710 1/20 0.34
ALDH1A1 P00352 2/20 0.33
PARP3 Q9Y6F1 1/20 0.33
IDO1 P14902 1/20 0.33
CYP2D6 P10635 2/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL8907884 0.79 S100A4 (0.36) KDM4EGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8908307 0.77 ACP3 (0.40) KDM4EGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2763287 0.75 SERPINE1 (0.47) SERPINE1KDM4EALDH1A1MEN1MAPT
SCHEMBL14028594 0.75 SERPINE1 (0.47) SERPINE1KDM4EALDH1A1MEN1MAPT
SCHEMBL13376141 0.75 SERPINE1 (0.47) SERPINE1KDM4EALDH1A1MEN1MAPT
SCHEMBL13377604 0.75 SERPINE1 (0.47) SERPINE1KDM4EALDH1A1MEN1MAPT
SCHEMBL8907599 0.71 CYP1A2 (0.38) KDM4EPOLBRAB9APAX8ALDH1A1
SCHEMBL8908933 0.69 HTR2C (0.40) POLBALDH1A1CYP2D6CYP3A4CYP2C9
SCHEMBL8908407 0.68 ALDH1A1 (0.39) POLBALDH1A1CYP2D6CYP3A4CYP2C9
SCHEMBL8908855 0.68 CYP1A2 (0.44) APAF1POLBRAB9AALDH1A1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0682657-B1 9H-INDENO[1,2-b]PYRAZINE-3(4H)-ONES AND 9H-INDENO[1,2-b]PYRAZINE-2,3(1H,4H)-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1997-11-19 EP claimed
US-5646146-A CENTRAL NERVOUS SYSTEM DISORDERS NOVO NORDISK A/S (DK) 1997-07-08 US claimed
EP-0682657-A1 9H-INDENO[1,2-b]PYRAZINE-3(4H)-ONES AND 9H-INDENO[1,2-b]PYRAZINE-2,3(1H,4H)-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1995-11-22 EP claimed
WO-1994018175-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1994-08-18 WO claimed
EP-0682657-B1 9H-INDENO[1,2-b]PYRAZINE-3(4H)-ONES AND 9H-INDENO[1,2-b]PYRAZINE-2,3(1H,4H)-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1997-11-19 EP disclosed
US-5646146-A CENTRAL NERVOUS SYSTEM DISORDERS NOVO NORDISK A/S (DK) 1997-07-08 US disclosed
EP-0682657-A1 9H-INDENO[1,2-b]PYRAZINE-3(4H)-ONES AND 9H-INDENO[1,2-b]PYRAZINE-2,3(1H,4H)-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1995-11-22 EP disclosed
US-5468748-A Nervous system and psychological disorders; antagonize glycine binding site on N-methylaspartic acid receptor complex NOVO NORDISK A/S (DK) 1995-11-21 US disclosed
WO-1994018175-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1994-08-18 WO disclosed