SCHEMBL4459978

SCHEMBL4459978

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nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
THRB P10828 1/20 0.48
ALOX15 P16050 1/20 0.48
NFKB1 P19838 1/20 0.48
PTGS2 P35354 1/20 0.48
THPO P40225 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
ALDH1A1 P00352 3/20 0.47
GNPAT O15228 2/20 0.41
LMNA P02545 1/20 0.41
FOLH1 Q04609 3/20 0.36
RIMKLA Q8IXN7 1/20 0.36
NAALAD2 Q9Y3Q0 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
CA2 P00918 1/20 0.34

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
SCHEMBL4459983 1.00 SMN1; SMN2 (0.48) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL9636364 0.83 MAPT (0.57) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL9636369 0.83 MAPT (0.57) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL4456772 0.81 MAPT (0.52) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL221192 0.81 MAPT (0.52) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL221191 0.81 MAPT (0.52) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL109681 0.79 LMNA (0.55) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL109682 0.79 LMNA (0.55) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL109680 0.79 LMNA (0.55) SMN1; SMN2MAPTKDM4ETHRBALOX15
SCHEMBL1332039 0.79 LMNA (0.55) SMN1; SMN2MAPTKDM4ETHRBALOX15

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
WO-2009151744-A1 S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES GALLEON PHARMACEUTICALS, INC. (US) 2009-12-17 WO claimed
WO-2009151744-A1 S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES GALLEON PHARMACEUTICALS, INC. (US) 2009-12-17 WO disclosed