SCHEMBL7473579

SCHEMBL7473579

COc1nc2cc(Cl)c(Cl)c(N(S(C)(=O)=O)S(C)(=O)=O)c2nc1OC

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 7/20 0.35
HRH4 Q9H3N8 1/20 0.35
GRIN1 Q05586 3/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PTGES O14684 1/20 0.31
LRRK2 Q5S007 1/20 0.30
NQO2 P16083 1/20 0.30

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
SCHEMBL7476576 0.81 GRIN1 (0.35) GLP1RHRH4GRIN1
SCHEMBL8650855 0.81 GRIN1 (0.42) GLP1RHRH4GRIN1
SCHEMBL7470542 0.81 GRIN1 (0.39) GLP1RHRH4GRIN1
SCHEMBL7467566 0.80 GRIN1 (0.39) GRIN1KDM4EMAPK1
SCHEMBL8488510 0.80 GRIN1 (0.49) GRIN1KDM4E
SCHEMBL8930771 0.80 ALDH1A1 (0.30) HSD17B10
SCHEMBL7471935 0.80 GLP1R (0.33) GLP1RHRH4
SCHEMBL7471473 0.80 GRIN1 (0.34) GLP1RHRH4GRIN1KDM4E
SCHEMBL7471934 0.80 GRIN1 (0.50) GLP1RHRH4GRIN1
SCHEMBL7470510 0.80 RAB9A (0.46) GRIN1KDM4EMAPK1

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-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
EP-0783495-A1 QUINOXALINE DERIVATIVES USEFUL IN THERAPY Pfizer Limited (GB) 1997-07-16 EP disclosed
WO-1996009295-A1 QUINOXALINE DERIVATIVES USEFUL IN THERAPY PFIZER LIMITED (GB) 1996-03-28 WO disclosed