SCHEMBL3433239

SCHEMBL3433239

c1coc(-c2ccc3nc(-c4ccc5c(c4)CCO5)cn3c2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.62
RAB9A P51151 9/20 0.51
NPC1 O15118 8/20 0.51
MAPT P10636 7/20 0.51
KDM4E B2RXH2 7/20 0.51
PKM P14618 3/20 0.51
ALDH1A1 P00352 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
DYRK1A Q13627 2/20 0.44
DNMT1 P26358 1/20 0.43
ALDH1A2 O94788 1/20 0.39
ALDH1A3 P47895 1/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
NFKB2 Q00653 1/20 0.38

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
SCHEMBL217664 0.79 RAB9A (0.47) ADORA2ARAB9ANPC1MAPTKDM4E
SCHEMBL6389418 0.79 RAB9A (0.74) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL3430260 0.77 NR4A2 (0.62) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL6522754 0.75 NR4A2 (0.63) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL219310 0.74 RAB9A (0.48) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL217274 0.74 RAB9A (0.53) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL3429813 0.74 NR4A2 (0.48) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL12987386 0.72 RAB9A (0.71) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL3431823 0.72 NR4A2 (0.64) RAB9ANPC1MAPTKDM4EPKM
SCHEMBL23407619 0.70 ALDH1A1 (0.68) RAB9ANPC1MAPTKDM4EPKM

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-2262804-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- A] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-aventis (FR) 2010-12-22 EP claimed
WO-2009144392-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- Α] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-12-03 WO claimed
EP-2262804-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- A] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-aventis (FR) 2010-12-22 EP disclosed
WO-2009144392-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- Α] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-12-03 WO disclosed