SCHEMBL7200867

SCHEMBL7200867

COc1ccc(-c2cc3c(OC)cc(OC)cc3n(CCC(=O)OCc3ccccc3)c2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
TNFRSF1A P19438 1/20 0.40
HSD17B10 Q99714 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
POLB P06746 1/20 0.39
NPC1 O15118 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PRNP P04156 1/20 0.38
PLA2G2A P14555 1/20 0.38

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
SCHEMBL7199062 0.91 SMN1; SMN2 (0.49) EGLN1SMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL6170913 0.85 KMO (0.48) EGLN1LMNAALDH1A1MEN1KMT2A
SCHEMBL7191760 0.82 DYRK1A (0.43) EGLN1MAPTPOLBHDAC6
SCHEMBL6170336 0.81 KMO (0.44) EGLN1MAPTHDAC6
SCHEMBL6169951 0.79 TSPO (0.46) EGLN1LMNAALDH1A1MEN1KMT2A
SCHEMBL6170009 0.79 EGLN1 (0.42) EGLN1
SCHEMBL6170872 0.78 TDP1 (0.46) ALDH1A1HSD17B10NPC1
SCHEMBL7813546 0.75 HDAC6 (0.41) HDAC6
SCHEMBL6168228 0.75 KDM4E (0.46) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL6170477 0.74 HASPIN (0.42) ALDH1A1KMT2AHSD17B10NPC1

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-6593342-B1 Activity on the proliferation of clonogenic cells in tumours and comprising an efficient amount of a compound selected among the compounds LABORATOIRE L. LAFON (FR) 2003-07-15 US disclosed