SCHEMBL7678635

SCHEMBL7678635

COc1nc2cc(Cl)c(Cl)c([N+](=O)[O-])c2nc1OC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 1/20 0.50
TSHR P16473 1/20 0.47
DCTPP1 Q9H773 16/20 0.46
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36

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
SCHEMBL7472951 0.82 EPAS1 (0.39) GLP1RTSHRDCTPP1MEN1KMT2A
SCHEMBL7476184 0.82 GLP1R (0.44) GLP1RTSHRDCTPP1MEN1KMT2A
SCHEMBL5722832 0.80 GLP1R (0.46) GLP1RTSHRDCTPP1
SCHEMBL5722680 0.80 TSHR (0.55) GLP1RTSHRDCTPP1GRIN2DGRIN3B
SCHEMBL6932438 0.77 ALDH1A1 (0.41) TSHRMEN1KMT2A
SCHEMBL6934708 0.75 MEN1 (0.59) MEN1KMT2A
SCHEMBL7473964 0.74 HRH4 (0.39) DCTPP1MEN1KMT2A
SCHEMBL6680601 0.73 HRH4 (0.38) GLP1R
SCHEMBL7676206 0.73 HRH4 (0.38)
SCHEMBL7465352 0.73 EPAS1 (0.40) GLP1RTSHRDCTPP1MEN1KMT2A

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
US-6376490-B1 STRONG N-METHYL-D-ASPARATE RECEPTOR ANTAGONISTS; USEFUL IN TREATING STROKES, ISCHEMIA, AND CENTRAL NERVOUS SYSTEM INJURIES PFIZER INC 2002-04-23 US disclosed
EP-0885212-B1 QUINOXALINEDIONES PFIZER RES AND BR DEV COMPANY (IE) 2001-11-14 EP disclosed
EP-0885212-A1 QUINOXALINEDIONES Pfizer Research and Development Company, N.V./S.A. (IE) 1998-12-23 EP disclosed
WO-1997032873-A1 QUINOXALINEDIONES PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) 1997-09-12 WO disclosed