SCHEMBL1664181

SCHEMBL1664181

O=C(Nc1ccc(Nc2ccc(Nc3ccc(N4CCC(O)CC4)cc3)cc2)cc1)c1ccc2c(ccn2CCN2CCOCC2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.50
MAPK1 P28482 3/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 3/20 0.50
POLB P06746 2/20 0.50
USP2 O75604 1/20 0.50
ATM Q13315 1/20 0.46
RAB9A P51151 6/20 0.45
NPC1 O15118 5/20 0.45
KMT2A Q03164 4/20 0.45
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MEN1 O00255 3/20 0.44
PKM P14618 2/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
MCL1 Q07820 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 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
SCHEMBL1664183 0.99 MAPT (0.49) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL1664636 0.89 RAB9A (0.45) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL1664637 0.88 RAB9A (0.45) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL1665099 0.88 LMNA (0.47) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL21254423 0.85 NPC1 (0.49) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL1664634 0.84 MAPK10 (0.51) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL1663566 0.82 MAOB (0.53) MAPTMAPK1LMNAPOLBATM
SCHEMBL1663605 0.82 RAB9A (0.45) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL1663608 0.81 RAB9A (0.45) MAPTMAPK1ALDH1A1LMNAPOLB
SCHEMBL1666178 0.81 MAPK10 (0.41) MAPTMAPK1ALDH1A1LMNAPOLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed