SCHEMBL1664576

SCHEMBL1664576

CCn1ccc(C(=O)Nc2ccc(Nc3ccc(Nc4ccc(N5CCC(O)CC5)cc4)cc3)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.46
MAPT P10636 8/20 0.44
NPC1 O15118 8/20 0.44
RAB9A P51151 8/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 4/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HPGDS O60760 1/20 0.44
MEN1 O00255 3/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MCL1 Q07820 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
USP2 O75604 2/20 0.43
POLB P06746 1/20 0.42
TP53 P04637 2/20 0.42
PKM P14618 2/20 0.42
ATM Q13315 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
SCHEMBL1664579 0.98 MAPT (0.47) SMN1; SMN2MAPTNPC1RAB9AKMT2A
SCHEMBL1665275 0.89 SLC2A1 (0.38) SMN1; SMN2MAPTNPC1RAB9AGAA
SCHEMBL1665277 0.87 NPC1 (0.41) SMN1; SMN2MAPTNPC1RAB9AKMT2A
SCHEMBL1662766 0.83 RAB9A (0.51) SMN1; SMN2MAPTNPC1RAB9AKMT2A
SCHEMBL8769706 0.82 RAB9A (0.58) SMN1; SMN2MAPTNPC1RAB9AKMT2A
SCHEMBL1663623 0.82 RAB9A (0.46) SMN1; SMN2MAPTNPC1RAB9AGAA
SCHEMBL21254928 0.79 RAB9A (0.55) SMN1; SMN2MAPTNPC1RAB9AKMT2A
SCHEMBL1664091 0.79 HPGDS (0.50) SMN1; SMN2MAPTNPC1RAB9AKMT2A
SCHEMBL6125886 0.79 MCHR1 (0.46) SMN1; SMN2MAPTNPC1RAB9AGAA
SCHEMBL6125887 0.79 MCHR1 (0.46) SMN1; SMN2MAPTNPC1RAB9AGAA

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