SCHEMBL17258283

SCHEMBL17258283

O=C(O)c1cccc2c1C(=O)N(O)C2=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MAPT P10636 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
LMNA P02545 2/20 0.53
ERCC1 P07992 2/20 0.48
FEN1 P39748 2/20 0.48
ERCC4 Q92889 2/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
LIG1 P18858 1/20 0.46
HNF4A P41235 1/20 0.46
MYC P01106 1/20 0.44
HSD17B10 Q99714 1/20 0.44
POLB P06746 3/20 0.44
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41
ALOX12 P18054 1/20 0.41
KDM4E B2RXH2 2/20 0.41
TYMS P04818 1/20 0.40

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
SCHEMBL9496052 0.80 ALDH1A1 (0.51) ALDH1A1MAPTL3MBTL1LMNACTDSP1
SCHEMBL9330751 0.80 CYP1A2 (0.43) ALDH1A1MAPTL3MBTL1LMNACTDSP1
SCHEMBL3220858 0.80 MAPT (0.50) ALDH1A1MAPTLMNAERCC1FEN1
SCHEMBL9405313 0.77 CTDSP1 (0.65) ALDH1A1MAPTL3MBTL1LMNACTDSP1
SCHEMBL11845327 0.76 CTDSP1 (0.67) ALDH1A1MAPTL3MBTL1LMNACTDSP1
SCHEMBL10760839 0.76 CA12 (0.46) ALDH1A1L3MBTL1ERCC1FEN1ERCC4
SCHEMBL9328562 0.76 APEX1 (0.58) ALDH1A1MAPTL3MBTL1LMNACTDSP1
SCHEMBL11746465 0.76 POLB (0.41) ALDH1A1MAPTL3MBTL1LMNAERCC1
SCHEMBL7100215 0.76 MAPT (0.53) ALDH1A1MAPTHSD17B10ALOX15CYP1A2
SCHEMBL69716 0.75 ALDH1A1 (0.69) ALDH1A1MAPTL3MBTL1LMNALIG1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107759460-A A kind of method for preparing the more acid monomers of polyphenyls 朱翠英 2018-03-06 CN claimed
CN-107698445-A A kind of method for preparing the more formic acid analog derivatives of aromatic hydrocarbons 朱翠英 2018-02-16 CN disclosed
CN-107698437-A A kind of method for preparing the more formic acid analog derivatives of aromatic hydrocarbons 朱翠英 2018-02-16 CN disclosed
CN-107698436-A Method for preparing aromatic polycarboxylic acid derivative 朱翠英 2018-02-16 CN disclosed
CN-107698438-A A kind of method for preparing the more formic acid analog derivatives of aromatic hydrocarbons 朱翠英 2018-02-16 CN disclosed
US-20150328329-A1 LIGANDS THAT TARGET HCV-E2 BINDING SITES ON CD81 AND THERAPEUTIC METHODS USING THEM American University of Cairo (EG) 2015-11-19 US disclosed