SCHEMBL15225895

SCHEMBL15225895

COc1ccc(-c2cc(-c3ccco3)cc(C=O)c2OC)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 7/20 0.62
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPK1 P28482 2/20 0.47
TP53 P04637 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ADORA2A P29274 4/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
POLB P06746 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ADORA1 P30542 1/20 0.45
PIK3R1 P27986 1/20 0.42
PIK3CA P42336 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
SCHEMBL4033908 0.89 ERN1 (0.55) ERN1MEN1KMT2AMAPK1TP53
SCHEMBL4036698 0.81 ERN1 (0.68) ERN1MEN1KMT2AMAPK1TP53
SCHEMBL4035630 0.78 ERN1 (0.62) ERN1
SCHEMBL15226080 0.78 ERN1 (0.52) ERN1MEN1KMT2AMAPK1TP53
SCHEMBL11634342 0.77 MEN1 (0.66) ERN1MEN1KMT2AMAPK1TP53
SCHEMBL12767031 0.77 ERN1 (1.00) ERN1
SCHEMBL4041509 0.76 ERN1 (0.56) ERN1ADORA2AGAAPIK3R1PIK3CA
SCHEMBL4042640 0.75 ERN1 (0.49) ERN1MEN1KMT2AMAPK1TP53
SCHEMBL2388588 0.74 MAPT (0.64) ERN1MEN1KMT2AMAPK1TP53
SCHEMBL4036525 0.73 ERN1 (0.55) ERN1MEN1KMT2AALDH1A1MAPT

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-2066632-B1 BENZOPHENONE DERIVATIVES USEFUL FOR INHIBITING FORMATION OF MICROTUBULE CHONG KUN DANG PHARM CORP (KR) 2013-09-04 EP disclosed