SCHEMBL11071978

SCHEMBL11071978

C=CCc1c2oc(=O)cc(C)c2cc2c(=O)cc(OC(=O)O)oc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.54
KDM4E B2RXH2 7/20 0.54
GLA P06280 4/20 0.54
CA9 Q16790 1/20 0.39
SRD5A1 P18405 2/20 0.38
MCL1 Q07820 2/20 0.38
LMNA P02545 3/20 0.37
HTT P42858 2/20 0.37
HPGD P15428 3/20 0.37
KMT2A Q03164 3/20 0.37
HSD17B10 Q99714 2/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 4/20 0.36
ERAP1 Q9NZ08 2/20 0.36
HIF1A Q16665 1/20 0.36
MAPT P10636 2/20 0.36
UBE2N P61088 1/20 0.36
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL11066772 0.84 LMNA (0.41) GAAKDM4EGLAMCL1LMNA
SCHEMBL11071974 0.83 KDM4E (0.57) GAAKDM4EGLACA9MCL1
SCHEMBL11081738 0.83 KDM4E (0.49) GAAKDM4EGLACA9LMNA
SCHEMBL11077944 0.72 KDM4E (0.52) GAAKDM4EGLACA9MCL1
SCHEMBL11384270 0.71 SRD5A1 (0.67) GAAKDM4EGLACA9SRD5A1
SCHEMBL11071263 0.71 KDM4E (0.41) GAAKDM4EGLAMCL1LMNA
SCHEMBL11075633 0.71 KDM4E (0.70) GAAKDM4EGLACA9MCL1
SCHEMBL3878331 0.70 CA9 (0.65) GAAKDM4EGLACA9SRD5A1
SCHEMBL11098613 0.69 KDM4E (0.50) GAAKDM4EGLAMCL1LMNA
SCHEMBL7824982 0.68 LMNA (0.62) GAAKDM4EGLASRD5A1LMNA

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
EP-0108036-A1 Benzopyranones CIBA-GEIGY AG (CH) 1984-05-09 EP claimed
EP-0108036-A1 Benzopyranones CIBA-GEIGY AG (CH) 1984-05-09 EP disclosed