SCHEMBL8041202

SCHEMBL8041202

O=C(O)c1ccccc1NC(=O)C(Oc1ccccc1OCc1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSV O60911 3/20 0.52
CTSL P07711 3/20 0.52
KMT2A Q03164 2/20 0.51
CHRM4 P08173 1/20 0.50
CHRM3 P20309 1/20 0.50
CLCN2 P51788 1/20 0.50
BRD4 O60885 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SGMS2 Q8NHU3 3/20 0.49
CFD P00746 1/20 0.48
GAA P10253 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
PTGER1 P34995 1/20 0.45
MEN1 O00255 1/20 0.45
PPIA P62937 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
SCHEMBL8027769 0.90 ALDH1A1 (0.53) CTSVCTSLKMT2ABRD4TDP1
SCHEMBL8037897 0.85 CTSV (0.52) CTSVCTSLKMT2AL3MBTL1CFD
SCHEMBL8041170 0.77 KMT2A (0.47) KMT2AL3MBTL1GAAALDH1A1KDM4E
SCHEMBL8038282 0.77 PLK1 (0.50) KMT2ATDP1GAAALDH1A1KDM4E
SCHEMBL8039700 0.76 ALDH1A1 (0.49) KMT2ATDP1GAAALDH1A1KDM4E
SCHEMBL8039699 0.75 TSHR (0.58) KMT2ATDP1GAAALDH1A1KDM4E
SCHEMBL10340241 0.75 GAA (0.59) KMT2ATDP1L3MBTL1GAAALDH1A1
SCHEMBL7864368 0.74 L3MBTL1 (0.53) BRD4TDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL8041218 0.74 MEN1 (0.49) KMT2ATDP1GAAALDH1A1KDM4E
SCHEMBL112903 0.73 SGMS2 (0.66) KMT2AL3MBTL1SGMS2GAAALDH1A1

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-0806412-B1 BENZENE DERIVATIVES TEIJIN LTD (JP) 2000-04-05 EP disclosed