SCHEMBL26066041

SCHEMBL26066041

COc1ccc(C(=O)Nc2cc(OC)c(OC)c(OC)c2C)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.63
GAA P10253 3/20 0.63
ALDH1A1 P00352 6/20 0.61
MAPT P10636 5/20 0.61
KDM4E B2RXH2 4/20 0.61
HPGD P15428 3/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
LMNA P02545 2/20 0.61
POLB P06746 1/20 0.61
NPC1 O15118 5/20 0.59
RAB9A P51151 5/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
AHR P35869 2/20 0.59
F10 P00742 2/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
ALOX15 P16050 1/20 0.53
CYP1A2 P05177 1/20 0.52

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
SCHEMBL26066030 0.81 ALDH1A1 (0.70) TP53GAAALDH1A1MAPTKDM4E
SCHEMBL21870337 0.81 TP53 (0.56) TP53GAAALDH1A1MAPTKDM4E
SCHEMBL9190300 0.80 TP53 (0.73) TP53GAAALDH1A1MAPTMEN1
SCHEMBL26066045 0.78 KDM4E (0.65) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL24711273 0.78 LMNA (0.86) TP53GAAALDH1A1MAPTKDM4E
SCHEMBL28894148 0.78 TP53 (1.00) TP53GAAALDH1A1MAPTKDM4E
SCHEMBL14363235 0.77 TP53 (0.81) TP53GAAALDH1A1MAPTKDM4E
SCHEMBL31680510 0.76 SMN1; SMN2 (0.88) TP53GAAALDH1A1MAPTKDM4E
SCHEMBL31552888 0.76 ALDH1A1 (0.80) TP53GAAALDH1A1MAPTKDM4E
SCHEMBL15233665 0.76 ALDH1A1 (0.80) TP53GAAALDH1A1MAPTKDM4E

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-3628374-B1 BCL-3 INHIBITORS UNIV COLLEGE CARDIFF CONSULTANTS LTD (GB) 2023-08-30 EP disclosed