SCHEMBL4027602

SCHEMBL4027602

Cn1c(-c2ccccc2OCc2ccc(Cl)c(Cl)c2)nc(C(=O)O)c(O)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 4/20 0.46
RNASEH1 O60930 1/20 0.44
ERCC1 P07992 1/20 0.43
FEN1 P39748 1/20 0.43
ERCC4 Q92889 1/20 0.43
PTPRC P08575 1/20 0.42
PTPN1 P18031 1/20 0.42
FFAR1 O14842 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MAPT P10636 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.39
MITF O75030 1/20 0.39
TP53 P04637 1/20 0.39
XBP1 P17861 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL4029035 0.87 PTGER1 (0.42) PTGER1PTPRCPTPN1FFAR1NPC1
SCHEMBL6017876 0.79 WDR5 (0.49) MAPTHPGDSMN1; SMN2
SCHEMBL6017997 0.77 FEN1 (0.42) RNASEH1ERCC1FEN1ERCC4MAPT
SCHEMBL6017887 0.76 APEX1 (0.48) RAB9AHPGDPPARG
SCHEMBL6018089 0.72 TSHR (0.45) MAPTHPGDSMN1; SMN2
SCHEMBL6018056 0.72 CNR1 (0.51) HPGDPPARG
SCHEMBL6018460 0.71 CNR1 (0.46) HPGDMEN1KMT2APPARG
SCHEMBL8883184 0.71 NPC1 (0.63) PTGER1PTPRCPTPN1NPC1RAB9A
SCHEMBL6017677 0.70 LMNA (0.48) HPGD
SCHEMBL6018105 0.69 CNR1 (0.46) PPARG

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
EP-1470113-B1 PYRIMIDINONE VIRAL POLYMERASE INHIBITORS ANGELETTI P IST RICHERCHE BIO (IT) 2009-01-07 EP claimed
EP-1470113-B1 PYRIMIDINONE VIRAL POLYMERASE INHIBITORS ANGELETTI P IST RICHERCHE BIO (IT) 2009-01-07 EP disclosed