SCHEMBL8154964

SCHEMBL8154964

O=C(CO)c1oc2ccccc2c(=O)c1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.55
CA2 P00918 3/20 0.55
MAPT P10636 4/20 0.48
KDM4E B2RXH2 6/20 0.48
LMNA P02545 3/20 0.48
KMT2A Q03164 3/20 0.48
CYP3A4 P08684 2/20 0.48
MEN1 O00255 2/20 0.48
CA12 O43570 1/20 0.48
TP53 P04637 1/20 0.48
ABCB1 P08183 1/20 0.48
CALM1 P0DP23 1/20 0.48
AR P10275 1/20 0.48
PKM P14618 1/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48
CYP1B1 Q16678 1/20 0.48
CA9 Q16790 1/20 0.48
GAA P10253 3/20 0.47
ALDH1A1 P00352 4/20 0.45

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
SCHEMBL7857929 0.87 CA1 (0.57) CA1CA2MAPTKDM4ELMNA
SCHEMBL1133577 0.85 CA1 (0.58) CA1CA2MAPTKDM4ELMNA
SCHEMBL3417705 0.84 CA1 (0.61) CA1CA2MAPTKDM4ELMNA
SCHEMBL29591307 0.84 CA1 (0.61) CA1CA2MAPTKDM4ELMNA
Water SCHEMBL27449135 0.84 CA1 (0.56) CA1CA2MAPTKDM4ELMNA
SCHEMBL27438850 0.82 CA1 (0.58) CA1CA2MAPTKDM4ELMNA
SCHEMBL28291736 0.82 CA1 (0.62) CA1CA2MAPTKDM4ELMNA
SCHEMBL27716370 0.81 PTPN1 (0.66) CA1CA2MAPTKDM4ELMNA
SCHEMBL22349646 0.78 KDM4E (0.58) CA1CA2MAPTKDM4ELMNA
SCHEMBL1923200 0.77 KDM4E (0.59) CA1CA2MAPTKDM4ELMNA

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
JP-2000327692-A NEW ISOFLAVONE DERIVATIVE EZAKI GLICO CO LTD 2000-11-28 JP disclosed
WO-1997026269-A1 A PROCESS FOR OBTAINING AN ISOFLAVONE CONCENTRATE FROM A SOYBEAN EXTRACT ACDS TECHNOLOGIES, INC. (US) 1997-07-24 WO disclosed