SCHEMBL1663942

SCHEMBL1663942

O=C(Nc1ccc(Nc2ccc(Nc3ccc(N4CCC(O)CC4)cc3)cc2)cc1)c1cc[nH]n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.44
NPC1 O15118 8/20 0.44
MAPT P10636 7/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
GFER P55789 1/20 0.44
PKM P14618 1/20 0.44
HTT P42858 1/20 0.44
KLF5 Q13887 1/20 0.44
ALDH1A1 P00352 2/20 0.43
PDE7A Q13946 1/20 0.42
GAA P10253 1/20 0.42
EGFR P00533 3/20 0.41
SYK P43405 2/20 0.41
MITF O75030 1/20 0.41
TP53 P04637 1/20 0.41
HPGDS O60760 1/20 0.41
PDE7B Q9NP56 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL1663944 0.96 MAPT (0.46) RAB9ANPC1MAPTSMN1; SMN2GFER
SCHEMBL1664777 0.86 MAPK10 (0.41) RAB9ANPC1MAPTSMN1; SMN2PDE7A
SCHEMBL1664502 0.81 HDAC8 (0.54) RAB9ANPC1MAPTSMN1; SMN2PKM
SCHEMBL8769706 0.80 RAB9A (0.58) RAB9ANPC1MAPTSMN1; SMN2PKM
SCHEMBL1664778 0.79 MAOB (0.45) RAB9ANPC1MAPTSMN1; SMN2ALDH1A1
SCHEMBL1664750 0.79 MAPT (0.49) RAB9ANPC1MAPTSMN1; SMN2GFER
SCHEMBL1666297 0.79 ALDH1A1 (0.45) RAB9ANPC1MAPTSMN1; SMN2GFER
SCHEMBL1664967 0.79 NPC1 (0.71) RAB9ANPC1MAPTSMN1; SMN2GFER
SCHEMBL1666904 0.79 NPC1 (0.47) RAB9ANPC1MAPTSMN1; SMN2GFER
SCHEMBL1664752 0.77 MAPT (0.47) RAB9ANPC1MAPTSMN1; SMN2PKM

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