SCHEMBL1665855

SCHEMBL1665855

O=C(Nc1ccc(Nc2ccc(Nc3ccc(N4CCC(O)CC4)cc3)cc2)cc1)c1ccc2[nH]ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
RAB9A P51151 7/20 0.50
NPC1 O15118 6/20 0.50
KMT2A Q03164 4/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 3/20 0.50
POLB P06746 1/20 0.50
MCL1 Q07820 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CHRNA7 P36544 1/20 0.48
TRPV1 Q8NER1 1/20 0.46
LMNA P02545 1/20 0.45
TNIK Q9UKE5 1/20 0.44
ESR1 P03372 2/20 0.44
USP2 O75604 1/20 0.43

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
SCHEMBL1665857 0.99 MAOA (0.52) MAOAMAOBRAB9ANPC1KMT2A
SCHEMBL1664446 0.93 RAB9A (0.51) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1664449 0.92 ESR1 (0.52) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1664862 0.90 NPC1 (0.49) MAOAMAOBRAB9ANPC1KMT2A
SCHEMBL1664886 0.90 MAOB (0.58) MAOAMAOBRAB9ANPC1KMT2A
SCHEMBL1664909 0.89 ESR1 (0.58) RAB9ANPC1KMT2AMAPTMEN1
SCHEMBL1663842 0.89 MAOA (0.43) MAOAMAOBRAB9ANPC1KMT2A
SCHEMBL1664889 0.89 MAOA (0.57) MAOAMAOBRAB9ANPC1KMT2A
SCHEMBL1664865 0.89 NPC1 (0.51) MAOAMAOBRAB9ANPC1KMT2A
SCHEMBL1667400 0.89 NPC1 (0.51) MAOAMAOBRAB9ANPC1KMT2A

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