SCHEMBL1664636

SCHEMBL1664636

O=C(Nc1ccc(Nc2ccc(Nc3ccc(N4CCC(O)CC4)cc3)cc2)cc1)c1ccc2c(ccn2CCO)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.45
NPC1 O15118 9/20 0.45
MAPT P10636 5/20 0.45
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
POLB P06746 3/20 0.45
MCL1 Q07820 1/20 0.45
LMNA P02545 2/20 0.44
USP2 O75604 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.44
TNIK Q9UKE5 1/20 0.41
HPGD P15428 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TP53 P04637 1/20 0.40
ATM Q13315 1/20 0.40
HPGDS O60760 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL1664637 0.99 RAB9A (0.45) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1663605 0.93 RAB9A (0.45) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1663608 0.92 RAB9A (0.45) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1666178 0.90 MAPK10 (0.41) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1664181 0.89 MAPT (0.50) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1664183 0.88 MAPT (0.49) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1666179 0.86 MAOB (0.41) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1665348 0.86 TNIK (0.42) MAPTSMN1; SMN2POLBLMNAUSP2
SCHEMBL1663566 0.85 MAOB (0.53) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL27937019 0.84 KMT2A (0.48) RAB9ANPC1MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed