SCHEMBL11426178

SCHEMBL11426178

Nc1cccc(C(=O)Nc2cc(S(=O)(=O)O)cc3cccc(O)c23)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.63
HDAC1 Q13547 1/20 0.48
HSD17B10 Q99714 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
KAT6A Q92794 1/20 0.46
CASP6 P55212 2/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
KDM4C Q9H3R0 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
USP2 O75604 1/20 0.42
TIMP3 P35625 1/20 0.42
RECQL P46063 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ENPP2 Q13822 2/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL5567709 0.92 APEX1 (0.76) APEX1HDAC1HSD17B10SMN1; SMN2NPSR1
SCHEMBL11440872 0.91 APEX1 (0.63) APEX1HDAC1HSD17B10SMN1; SMN2NPSR1
SCHEMBL11426318 0.89 APEX1 (0.65) APEX1HDAC1SMN1; SMN2CASP6CTDSP1
SCHEMBL10907842 0.85 APEX1 (0.62) APEX1HSD17B10CASP6CTDSP1MEN1
SCHEMBL11339227 0.85 APEX1 (0.62) APEX1HSD17B10MEN1KMT2AMAPT
SCHEMBL11472832 0.85 APEX1 (0.58) APEX1HDAC1HSD17B10SMN1; SMN2NPSR1
SCHEMBL11427775 0.84 APEX1 (0.56) APEX1HSD17B10CASP6CTDSP1MEN1
SCHEMBL11440906 0.84 APEX1 (0.56) APEX1HSD17B10CASP6CTDSP1MEN1
SCHEMBL11433857 0.82 APEX1 (0.58) APEX1SMN1; SMN2CTDSP1MEN1KMT2A
SCHEMBL11347076 0.81 APEX1 (0.63) APEX1HSD17B10CASP6CTDSP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4216165-A Amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 US disclosed