SCHEMBL11071263

SCHEMBL11071263

CCCc1cc2c(C)cc(=O)oc2c2c(=O)cc(OC(=O)O)oc12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.41
GAA P10253 5/20 0.41
KMT2A Q03164 4/20 0.41
HSD17B10 Q99714 4/20 0.41
LMNA P02545 3/20 0.41
GLA P06280 3/20 0.41
HPGD P15428 3/20 0.41
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 5/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 4/20 0.38
UBE2N P61088 1/20 0.38
FHIT P49789 1/20 0.37
PAX8 Q06710 1/20 0.37
POLB P06746 1/20 0.36
MCL1 Q07820 1/20 0.36

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
SCHEMBL11081738 0.85 KDM4E (0.49) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11071258 0.83 ABCB11 (0.47) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11066772 0.82 LMNA (0.41) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11098613 0.76 KDM4E (0.50) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11071978 0.71 GAA (0.54) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL10038067 0.70 NFKB1 (0.56) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11392900 0.69 GPR35 (0.39) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11074157 0.68 KMT2A (0.57) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11075853 0.68 KDM4E (0.49) KDM4EGAAKMT2AHSD17B10LMNA
SCHEMBL11081735 0.67 KDM4E (0.52) KDM4EGAAKMT2AHSD17B10LMNA

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 claimed