SCHEMBL11065578

SCHEMBL11065578

COC(=O)c1cc(C)c(OC)cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.52
POLB P06746 4/20 0.47
ALDH1A1 P00352 6/20 0.46
HPGD P15428 5/20 0.46
GAA P10253 6/20 0.46
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 4/20 0.44
USP2 O75604 1/20 0.44
MAPT P10636 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RECQL P46063 1/20 0.43
PDGFRB P09619 1/20 0.42
FGFR1 P11362 1/20 0.42
PDGFRA P16234 1/20 0.42
FLT1 P17948 1/20 0.42
FGFR3 P22607 1/20 0.42
KDR P35968 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL3972997 0.90 KDM4E (0.63) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL6781993 0.88 KDM4E (0.56) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL31335674 0.88 GAA (0.54) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL2430255 0.87 KDM4E (0.50) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL13468054 0.85 KDM4E (0.49) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL27437761 0.85 HTT (0.52) KDM4EPOLBHPGDGAAHSD17B10
SCHEMBL26066718 0.84 KDM4E (0.46) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL23703855 0.83 KDM4E (0.47) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL14044062 0.83 GAA (0.58) KDM4EPOLBALDH1A1HPGDGAA
SCHEMBL14032887 0.83 KDM4E (0.47) KDM4EPOLBALDH1A1HPGDGAA

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
US-4444567-A ALKOXY BENZALDEHYDES, ALKOXY BENZOATES PHILLIPS PETROLEUM COMPANY (US) 1984-04-24 US disclosed