SCHEMBL1665027

SCHEMBL1665027

COCc1cc(C(=O)Nc2ccc(Nc3ccc(Nc4ccc(N5CCC(O)CC5)cc4)cc3)cc2)n(C)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.45
NPC1 O15118 10/20 0.41
RAB9A P51151 10/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 3/20 0.41
MAPK1 P28482 2/20 0.41
USP2 O75604 2/20 0.41
ESR2 Q92731 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
MEN1 O00255 3/20 0.41
LMNA P02545 2/20 0.41
RXFP1 Q9HBX9 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
PDE7A Q13946 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
LRRK2 Q5S007 1/20 0.39
MCL1 Q07820 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
SCHEMBL1665030 0.96 RAB9A (0.48) HPGDSNPC1RAB9APOLBKMT2A
SCHEMBL8771289 0.78 RAB9A (0.48) HPGDSNPC1RAB9APOLBKMT2A
SCHEMBL1665072 0.75 HPGDS (0.48) HPGDSNPC1RAB9AKMT2AMAPT
SCHEMBL1664840 0.74 HPGDS (0.61) HPGDSNPC1RAB9AKMT2AMAPT
SCHEMBL1663295 0.73 HPGDS (0.63) HPGDSNPC1RAB9AKMT2AMAPT
SCHEMBL8769706 0.73 RAB9A (0.58) NPC1RAB9AKMT2AMAPTMAPK1
SCHEMBL1664351 0.73 HPGDS (0.62) HPGDSNPC1RAB9AKMT2AMAPT
SCHEMBL1664007 0.73 RAB9A (0.51) NPC1RAB9AKMT2AMAPTMAPK1
SCHEMBL1664676 0.72 HPGDS (0.54) HPGDSNPC1RAB9APOLBKMT2A
SCHEMBL1665239 0.72 SMN1; SMN2 (0.46) HPGDSNPC1RAB9AKMT2AMAPT

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