SCHEMBL7679349

SCHEMBL7679349

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
PRNP P04156 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
PPARG P37231 1/20 0.40
HTT P42858 1/20 0.40
MAPK10 P53779 1/20 0.40
NCOA2 Q15596 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
JAK2 O60674 1/20 0.34
PARP1 P09874 1/20 0.34
HPGDS O60760 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
NQO2 P16083 2/20 0.33
PGK1 P00558 1/20 0.33
GAA P10253 3/20 0.33
HPGD P15428 2/20 0.33
FYN P06241 1/20 0.33
EPHB4 P54760 1/20 0.33

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
SCHEMBL7676275 0.87 ALDH1A1 (0.39) POLBMAPK1HRH4KDM4EALDH1A1
SCHEMBL7676315 0.83 ALDH1A1 (0.40) POLBTSHRHTTHPGDSHRH4
SCHEMBL7683407 0.77 POLB (0.36) POLBTSHRHTTNPSR1HRH4
SCHEMBL6680601 0.76 HRH4 (0.38) MAPK1HRH4NQO2PGK1GAA
SCHEMBL7676314 0.76 HPGD (0.45) POLBNPSR1GAAHPGDKDM4E
SCHEMBL7473964 0.74 HRH4 (0.39) HRH4NQO2PGK1SQOR
SCHEMBL7680466 0.74 CYP1A2 (0.39) TSHRMAPK1HTTPGK1HPGD
SCHEMBL7676206 0.73 HRH4 (0.38) HRH4NQO2PGK1
SCHEMBL7676333 0.73 HRH4 (0.35) HRH4NQO2
SCHEMBL7820043 0.73 HRH4 (0.35) HRH4NQO2

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