SCHEMBL5680962

SCHEMBL5680962

COc1ccc(OC)c(NC(=O)c2cc3c(cc2O)oc2ccccc23)c1

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.92
ALDH1A1 P00352 11/20 0.92
KDM4E B2RXH2 10/20 0.92
MEN1 O00255 6/20 0.92
KMT2A Q03164 6/20 0.92
LMNA P02545 6/20 0.92
NPSR1 Q6W5P4 4/20 0.92
HPGD P15428 9/20 0.57
TSHR P16473 4/20 0.57
HSD17B10 Q99714 4/20 0.57
SMN1; SMN2 Q16637 6/20 0.55
RAB9A P51151 4/20 0.55
NPC1 O15118 3/20 0.55
HSP90AA1 P07900 1/20 0.54
HDAC1 Q13547 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
ATM Q13315 1/20 0.53
GAA P10253 1/20 0.52
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
SCHEMBL6705537 0.96 MAPT (1.00) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL12368180 0.84 MAPT (0.72) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL3317902 0.81 MEN1 (0.70) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL29440795 0.81 MEN1 (0.70) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL29440796 0.81 MEN1 (0.70) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL331767 0.75 MAPT (0.59) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL2269427 0.74 GAA (0.62) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL8964494 0.74 KCNMA1 (0.64) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL4465486 0.73 TP53 (0.72) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL14363413 0.73 MEN1 (0.62) MAPTALDH1A1KDM4EMEN1KMT2A

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-1412578-B1 DYED AND/OR PRINTED NON-WOVEN FABRIC FREUDENBERG CARL KG (DE) 2006-01-04 EP claimed