SCHEMBL8907884

SCHEMBL8907884

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.36
KDM4E B2RXH2 2/20 0.34
GRIN2D O15399 2/20 0.34
GRIN3B O60391 2/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2A Q12879 2/20 0.34
GRIN2B Q13224 2/20 0.34
GRIN2C Q14957 2/20 0.34
GRIN3A Q8TCU5 2/20 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
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
USP8 P40818 1/20 0.31

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
SCHEMBL8907689 0.79 SERPINE1 (0.36) KDM4EGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8908307 0.73 ACP3 (0.40) KDM4EGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8907599 0.71 CYP1A2 (0.38) KDM4EPOLBRAB9APAX8ALDH1A1
SCHEMBL8908933 0.69 HTR2C (0.40) POLBALDH1A1TSHRSMN1; SMN2
SCHEMBL8908407 0.68 ALDH1A1 (0.39) POLBALDH1A1TSHRSMN1; SMN2
SCHEMBL8908855 0.68 CYP1A2 (0.44) APAF1POLBRAB9AALDH1A1TSHR
SCHEMBL8909107 0.68 TSHR (0.33) KDM4EPOLBRAB9AALDH1A1HPGD
SCHEMBL6904734 0.68 MEN1 (0.52) S100A4KDM4EAPAF1POLBRAB9A
SCHEMBL8907382 0.67 S100A4 (0.32) S100A4KDM4EAPAF1POLBRAB9A
SCHEMBL5343918 0.66 GPR3 (0.46) S100A4POLB

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 7 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-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