SCHEMBL7230749

SCHEMBL7230749

O=C(CCc1ccccc1O)Nc1cccc(C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.57
HTT P42858 1/20 0.57
RAB9A P51151 6/20 0.55
NPC1 O15118 5/20 0.55
GAA P10253 2/20 0.55
MAPT P10636 2/20 0.55
ALDH1A1 P00352 2/20 0.54
HPGD P15428 1/20 0.54
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
MITF O75030 2/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
PAX8 Q06710 1/20 0.49
KLF5 Q13887 1/20 0.49
POLB P06746 1/20 0.48
DAPK1 P53355 1/20 0.48

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
SCHEMBL21198560 0.86 POLB (0.56) SMN1; SMN2HTTRAB9ANPC1KMT2A
SCHEMBL31306634 0.86 POLB (0.56) SMN1; SMN2HTTRAB9ANPC1KMT2A
SCHEMBL27519915 0.85 SMN1; SMN2 (0.56) SMN1; SMN2HTTRAB9ANPC1GAA
SCHEMBL27546668 0.85 SMN1; SMN2 (0.56) SMN1; SMN2HTTRAB9ANPC1GAA
SCHEMBL27546578 0.85 NPC1 (0.56) SMN1; SMN2HTTRAB9ANPC1GAA
SCHEMBL7436440 0.85 SMN1; SMN2 (0.56) SMN1; SMN2HTTRAB9ANPC1GAA
SCHEMBL7434461 0.84 SMN1; SMN2 (0.55) SMN1; SMN2HTTRAB9ANPC1GAA
SCHEMBL14015952 0.84 SMN1; SMN2 (0.52) SMN1; SMN2HTTRAB9ANPC1GAA
SCHEMBL28745974 0.83 GAA (0.79) SMN1; SMN2HTTRAB9ANPC1GAA
SCHEMBL21197934 0.83 ANO1 (0.63) GAA

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-6602987-B1 4'-hydroxyazobenzene-2-carboxylic acid (HABA) compounds; useful as reagents for labeling, isolation and detection of biological molecules YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2003-08-05 US disclosed