SCHEMBL11079486

SCHEMBL11079486

CCCc1c(O)c(C(C)=O)cc2c(C)cc(=O)oc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.55
MAPT P10636 3/20 0.55
HSD17B10 Q99714 2/20 0.55
UBE2N P61088 1/20 0.55
HTT P42858 3/20 0.50
NCOA3 Q9Y6Q9 1/20 0.50
GAA P10253 6/20 0.49
GLA P06280 5/20 0.49
MCL1 Q07820 4/20 0.49
ALDH1A1 P00352 6/20 0.48
POLB P06746 3/20 0.48
ERAP1 Q9NZ08 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PABPC1 P11940 1/20 0.48
APEX1 P27695 1/20 0.48
RECQL P46063 1/20 0.48
ATM Q13315 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
SCHEMBL11075633 0.82 KDM4E (0.70) KDM4EMAPTHSD17B10UBE2NHTT
SCHEMBL11080686 0.81 KDM4E (0.52) KDM4EMAPTHSD17B10UBE2NHTT
SCHEMBL10975250 0.77 PDE5A (0.66) KDM4EMAPTMEN1KMT2AHPGD
SCHEMBL11075853 0.76 KDM4E (0.49) KDM4EMAPTHSD17B10UBE2NHTT
SCHEMBL10508426 0.76 PDE5A (0.53) KDM4EMAPTHSD17B10GAAALDH1A1
SCHEMBL11079352 0.75 GAA (0.63) KDM4EMAPTHSD17B10GAAGLA
SCHEMBL10687608 0.73 MEN1 (0.46) KDM4EMAPTMCL1POLBMEN1
SCHEMBL11066769 0.72 ABCB11 (0.49) KDM4EMAPTHSD17B10UBE2NGAA
SCHEMBL11066632 0.72 KDM4E (0.61) KDM4EMAPTHSD17B10HTTGAA
SCHEMBL10404717 0.71 KDM4E (0.64) KDM4EMAPTHSD17B10UBE2NGAA

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