SCHEMBL7947995

SCHEMBL7947995

O=c1c2c[nH]c3ccccc3n-2c(=O)n1-c1ccccc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
G6PD P11413 1/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
MGLL Q99685 1/20 0.37
MAPT P10636 3/20 0.36
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HSD17B10 Q99714 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
POLB P06746 1/20 0.35
PDE7A Q13946 1/20 0.35
GABRP O00591 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
SCHEMBL7953602 0.86 GLA (0.37) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL7948162 0.84 GAA (0.37) ALDH1A1KMT2AMEN1MAPTKDM4E
SCHEMBL7941785 0.83 LMNA (0.39) KMT2ASMN1; SMN2RAB9APOLBMPI
SCHEMBL7941798 0.82 PGR (0.46) KMT2AMEN1KDM4EPDE7AMPI
SCHEMBL7947998 0.81 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1MGLLMAPT
SCHEMBL7949055 0.80 MEN1 (0.38) ALDH1A1KMT2AMEN1MAPTKDM4E
SCHEMBL7941781 0.80 ADORA3 (0.43) ALDH1A1MGLLMAPTKDM4EPOLB
SCHEMBL7941792 0.77 SMN1; SMN2 (0.43) ALDH1A1KMT2AKDM4ESMN1; SMN2POLB
SCHEMBL7951665 0.77 LMNA (0.40) ALDH1A1G6PDKMT2AMEN1MAPT
SCHEMBL7949731 0.77 HSP90AA1 (0.41) ALDH1A1KMT2AMEN1MAPTKDM4E

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
US-6268496-B1 GAMMA-AMINOBUTYRIC ACID RECEPTOR LIGANDS NEUROGEN CORPORATION 2001-07-31 US claimed
EP-0555391-B1 CERTAIN IMIDAZOQUINOXALINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORP (US) 2000-07-12 EP claimed
EP-0555391-A1 CERTAIN IMIDAZOQUINOXALINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1993-08-18 EP claimed
US-5130430-A Anxiety, sleep disorders or seizures NEUROGEN CORPORATION (US) 1992-07-14 US claimed
WO-1992007853-A1 CERTAIN IMIDAZOQUINOXALINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1992-05-14 WO claimed
US-6268496-B1 GAMMA-AMINOBUTYRIC ACID RECEPTOR LIGANDS NEUROGEN CORPORATION 2001-07-31 US disclosed
US-5744602-A PSYCHOLOGICAL DISORDERS, ANTICONVULSANTS NEUROGEN CORPORATION (US) 1998-04-28 US disclosed