SCHEMBL7679216

SCHEMBL7679216

COc1nc2cc(Cl)c(Cl)c(-n3c(C)nnc3-c3nc(C)no3)c2nc1OC

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
LRRK2 Q5S007 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 1/20 0.31
GABRQ Q9UN88 1/20 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
SCHEMBL7673869 0.83 ALDH1A1 (0.43) TP53MAPT
SCHEMBL7676202 0.79 PTGES (0.33) HRH4
SCHEMBL7681996 0.79 TLR8 (0.36) HRH4
SCHEMBL7676442 0.77 NR1I3 (0.41) TP53MAPT
SCHEMBL7682619 0.75 TLR8 (0.38) HRH4
SCHEMBL7674269 0.73 CGAS (0.36)
SCHEMBL7683018 0.72 POLB (0.40) TP53MAPT
SCHEMBL7678787 0.71 HPGD (0.34) MAPT
SCHEMBL7682970 0.71 HRH4 (0.33) HRH4
SCHEMBL7677420 0.69 GLA (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3

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 2 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