SCHEMBL6224488

SCHEMBL6224488

Cc1cc(C)cc(COc2cccc3cccnc23)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.66
MAPT P10636 9/20 0.66
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
NPC1 O15118 3/20 0.64
RAB9A P51151 3/20 0.64
LMNA P02545 7/20 0.59
ALDH1A1 P00352 3/20 0.59
HPGD P15428 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
HTT P42858 2/20 0.59
MAPK1 P28482 1/20 0.59
POLB P06746 2/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
GAA P10253 2/20 0.54
NPSR1 Q6W5P4 2/20 0.53
HDAC6 Q9UBN7 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
SCHEMBL6026781 0.86 MEN1 (0.75) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL6026902 0.82 NPC1 (0.64) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL6026771 0.82 NPC1 (0.78) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL6220417 0.81 MEN1 (0.60) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL29360828 0.81 NPC1 (0.77) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL1101199 0.81 NPC1 (0.77) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL6027354 0.81 NPC1 (0.62) KDM4EMAPTMEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL4754679 0.80 NPC1 (0.74) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL6026657 0.80 NPC1 (0.74) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL20068101 0.79 MEN1 (0.60) KDM4EMAPTMEN1KMT2ANPC1

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-1266887-B1 Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-08-17 EP disclosed