SCHEMBL7678787

SCHEMBL7678787

CCOC(=O)Cc1nnc(C)n1-c1c(Cl)c(Cl)cc2nc(OC)c(OC)nc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.34
RAB9A P51151 1/20 0.33
PDE7B Q9NP56 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
TNF P01375 2/20 0.32
POLB P06746 1/20 0.32
BRD4 O60885 1/20 0.32
DYRK1A Q13627 1/20 0.31
AKT1 P31749 1/20 0.31
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 1/20 0.31
CASP1 P29466 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL7681996 0.84 TLR8 (0.36)
SCHEMBL7683018 0.84 POLB (0.40) HPGDSMN1; SMN2MAPTMEN1KMT2A
SCHEMBL7682619 0.82 TLR8 (0.38)
SCHEMBL7676202 0.76 PTGES (0.33) MEN1KMT2A
SCHEMBL7682502 0.73 PDE2A (0.43) HPGDMAPTMEN1KMT2ATSHR
SCHEMBL7682046 0.73 POLB (0.37) RAB9ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL7679216 0.71 TP53 (0.33) MAPT
SCHEMBL7677420 0.71 GLA (0.36)
SCHEMBL7676180 0.71 ACHE (0.40) HPGDRAB9ASMN1; SMN2MAPTMEN1
SCHEMBL7676442 0.70 NR1I3 (0.41) SMN1; SMN2MAPTMEN1KMT2AL3MBTL1

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