SCHEMBL8317441

SCHEMBL8317441

CCOC(=O)c1nccn1C1Cc2cc(C#N)ccc2C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.41
GABRG2 P18507 3/20 0.41
GABRB3 P28472 3/20 0.41
GABRA5 P31644 3/20 0.41
GABRA3 P34903 3/20 0.41
GABRA2 P47869 3/20 0.41
ELANE P08246 5/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
NPEPPS P55786 1/20 0.36
HRH2 P25021 1/20 0.35
HRH1 P35367 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRM5 P41594 1/20 0.35
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL8880656 0.87 METAP1 (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8881385 0.85 GABRG2 (0.41) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8880563 0.85 GABRG2 (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8880066 0.85 HRH1 (0.43) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8881176 0.84 CYP19A1 (0.43) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8091069 0.83 TBXAS1 (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8879965 0.83 MAPT (0.46) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8314308 0.82 GABRG2 (0.39) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL8880567 0.80 PDE3B (0.44) CYP2C9MAPTKMT2AKDM4EMEN1
SCHEMBL8098958 0.80 ELANE (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0752991-B1 IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZIN-4-ONES ANTAGONISTS OF AMPA AND NMDA RECEPTORS RHONE POULENC RORER SA (FR) 1999-05-26 EP disclosed
US-5789406-A Indeno 1,2-E!pyrazine-4-ones, their preparation and the medicaments containing them RHONE-POULENC RORER S.A. (FR) 1998-08-04 US disclosed
EP-0752991-A1 INDENO[1,2-e]PYRAZINE-4-ONES, PREPARATION THEREOF AND DRUGS CONTAINING SAME Aventis Pharma S.A. (FR) 1997-01-15 EP disclosed
WO-1995026349-A1 INDENO[1,2-e]PYRAZINE-4-ONES, PREPARATION THEREOF AND DRUGS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1995-10-05 WO disclosed