SCHEMBL7470948

SCHEMBL7470948

CCc1c(Cl)cc2nc(OC)c(OC)nc2c1NS(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 4/20 0.33
ALDH1A1 P00352 3/20 0.32
GAA P10253 1/20 0.32
NPY1R P25929 1/20 0.32
CCR4 P51679 1/20 0.32
PGK1 P00558 1/20 0.32
GSK3B P49841 1/20 0.32
MAP4K2 Q12851 1/20 0.32
ACLY P53396 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PGR P06401 1/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
EPHX2 P34913 2/20 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
SCHEMBL8935248 0.93 PIK3CA (0.32) GLP1RPIK3CA
SCHEMBL7466587 0.84 CCR4 (0.36) GLP1RALDH1A1GAANPY1RCCR4
SCHEMBL7465420 0.84 SMN1; SMN2 (0.33) ALDH1A1GAANPY1RCCR4KDM4E
SCHEMBL7476942 0.83 ALDH1A1 (0.38) GLP1RALDH1A1GAANPY1RCCR4
SCHEMBL7475650 0.82 CCR4 (0.35) CCR4ACLYKDM4EMAPTMEN1
SCHEMBL8935311 0.81 SMN1; SMN2 (0.32) ALDH1A1GAANPY1RCCR4KDM4E
SCHEMBL7467654 0.79 NPY1R (0.37) ALDH1A1GAANPY1RCCR4ACLY
SCHEMBL7468793 0.78 CCR4 (0.36) ALDH1A1GAANPY1RCCR4SMN1; SMN2
SCHEMBL7462801 0.77 CCR4 (0.36) GLP1RCCR4PGK1GSK3BMAP4K2
SCHEMBL7468982 0.75 ALDH1A1 (0.45) ALDH1A1GAANPY1RKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783495-B1 QUINOXALINE DERIVATIVES USEFUL IN THERAPY PFIZER LTD (GB) 2002-02-27 EP disclosed
US-5863917-A ANXIOLYTIC AGENT, ANTICONVULSANTS, ANALGESICS AND NEUROPROTECTIVES. PFIZER, INC. (US) 1999-01-26 US disclosed
US-5852016-A Quinoxaline derivatives useful in therapy PFIZER INC. (US) 1998-12-22 US disclosed
WO-1997031902-A1 QUINOXALINE DERIVATIVES USEFUL IN THERAPY PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) 1997-09-04 WO disclosed
EP-0792874-A1 Quinoxaline derivatives useful in therapy Pfizer Limited (GB) 1997-09-03 EP disclosed
WO-1996009295-A1 QUINOXALINE DERIVATIVES USEFUL IN THERAPY PFIZER LIMITED (GB) 1996-03-28 WO disclosed