SCHEMBL1667308

SCHEMBL1667308

O=C(c1ccc(NC(=O)c2cccc3cc[nH]c23)cc1)c1ccc(Nc2ccc(N3CCC(O)CC3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.46
RAB9A P51151 10/20 0.43
NPC1 O15118 8/20 0.43
KMT2A Q03164 6/20 0.43
MAPT P10636 6/20 0.43
MEN1 O00255 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
MCL1 Q07820 2/20 0.43
POLB P06746 1/20 0.43
TNIK Q9UKE5 1/20 0.43
GFER P55789 1/20 0.42
ALDH1A1 P00352 4/20 0.41
TP53 P04637 2/20 0.40
SYK P43405 1/20 0.40
MAPK1 P28482 3/20 0.40
GAA P10253 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL8771583 0.95 RAB9A (0.47) GRM5RAB9ANPC1KMT2AMAPT
SCHEMBL1664061 0.85 DHPS (0.50) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1667309 0.84 RAB9A (0.41) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1664961 0.81 NPC1 (0.65) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL8770716 0.80 DHPS (0.53) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1664064 0.79 RAB9A (0.40) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL13836253 0.79 NPC1 (0.42) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1664358 0.79 NPC1 (0.46) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL6126136 0.78 ACKR3 (0.44) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1664446 0.78 RAB9A (0.51) RAB9ANPC1KMT2AMAPTMEN1

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