SCHEMBL7516254

SCHEMBL7516254

O=C(O)Oc1ccc2cc(O)c(OC(=O)O)cc2c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.42
MEN1 O00255 7/20 0.42
MAPT P10636 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
ESR1 P03372 5/20 0.41
ESR2 Q92731 3/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
LCK P06239 1/20 0.38
KDM4E B2RXH2 2/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL8604907 0.89 KMT2A (0.47) KMT2AMEN1MAPTTDP1ESR1
SCHEMBL9647188 0.89 KMT2A (0.47) KMT2AMEN1MAPTTDP1ESR1
SCHEMBL27499512 0.84 HPGD (0.43) KMT2AMEN1MAPTTDP1SMN1; SMN2
SCHEMBL2760999 0.83 HPGD (0.46) KMT2AMEN1MAPTTDP1SMN1; SMN2
SCHEMBL10437720 0.83 MAPT (0.44) KMT2AMEN1MAPTTDP1NPC1
SCHEMBL11298874 0.82 KMT2A (0.52) KMT2AMEN1MAPTTDP1SMN1; SMN2
SCHEMBL4423206 0.82 KMT2A (0.57) KMT2AMEN1MAPTTDP1ESR1
SCHEMBL809274 0.82 KMT2A (0.55) KMT2AMEN1MAPTTDP1SMN1; SMN2
SCHEMBL7551541 0.81 KDM4E (0.46) KMT2AMEN1MAPTTDP1HTT
SCHEMBL7519561 0.77 KMT2A (0.53) KMT2AMEN1MAPTTDP1ESR1

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
EP-0803492-B1 METHOD FOR SEPARATING AND PURIFYING HYDROXYNAPHTHALENECARBOXYLIC ACIDS UENO SEIYAKU OYO KENKYUJO KK (JP) 2002-02-06 EP claimed