SCHEMBL27656166

SCHEMBL27656166

O=C(OS(=O)(=O)O)c1ccccc1.[Cu]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
F2 P00734 1/20 0.54
TSHR P16473 6/20 0.50
TDP1 Q9NUW8 4/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 3/20 0.44
POLB P06746 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP3A4 P08684 1/20 0.44
PARP1 P09874 1/20 0.44
CYP2C19 P33261 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PARP10 Q53GL7 1/20 0.44
ALDH1A1 P00352 4/20 0.44
KMT2A Q03164 3/20 0.44
MAPK1 P28482 1/20 0.44
HIF1A Q16665 1/20 0.44

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
SCHEMBL4818821 0.98 LMNA (0.56) LMNAF2TSHRTDP1TP53
SCHEMBL27260003 0.96 LMNA (0.54) LMNAF2TSHRTDP1TP53
SCHEMBL28895613 0.96 LMNA (0.54) LMNAF2TSHRTDP1TP53
SCHEMBL27445547 0.94 LMNA (0.52) LMNAF2TSHRTDP1TP53
Ammonia Solution, Strong SCHEMBL10821885 0.94 LMNA (0.52) LMNAF2TSHRTDP1TP53
Ammonia Solution, Strong SCHEMBL10821942 0.94 LMNA (0.52) LMNAF2TSHRTDP1TP53
SCHEMBL27289303 0.94 LMNA (0.52) LMNAF2TSHRTDP1TP53
Terephthalic Acid SCHEMBL27293406 0.88 TSHR (0.52) LMNAF2TSHRTDP1TP53
SCHEMBL17024401 0.86 STS (0.39) LMNAF2TSHRTDP1RECQL
Terephthalic Acid SCHEMBL27293405 0.85 CA2 (0.59) LMNAF2TSHRTDP1TP53

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
CN-1968751-B Process for halogenation of aromatic compounds SABIC INNOVATIVE PLASTICS IP 2011-08-03 CN disclosed
CN-1968751-A Catalyst composition and process for halogenation of aromatic compounds GEN ELECTRIC (US) 2007-05-23 CN disclosed