SCHEMBL6587170

SCHEMBL6587170

Cc1ccc2c(c1)C(Nc1ccc(N3CCOCC3)cc1)CC(C)N2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 13/20 0.42
ALDH1A1 P00352 8/20 0.42
ALOX12 P18054 4/20 0.42
MAPK1 P28482 4/20 0.41
TP53 P04637 3/20 0.41
PKM P14618 1/20 0.41
USP2 O75604 1/20 0.41
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KIF11 P52732 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL4196392 0.84 CHRNB2 (0.38) MAPT
SCHEMBL6514954 0.84 CHRNB2 (0.38) MAPT
SCHEMBL6514956 0.84 CHRNB2 (0.38) MAPT
SCHEMBL4196389 0.84 CHRNB2 (0.38) MAPT
SCHEMBL4196397 0.84 CHRNB2 (0.38) MAPT
SCHEMBL5835889 0.75 BRD4 (0.60)
SCHEMBL5835876 0.75 BRD4 (0.60)
SCHEMBL2741200 0.75 BRD4 (0.60)
SCHEMBL6522689 0.74
SCHEMBL6522687 0.74

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-1377553-A1 TETRAHYDROQUINOLINE DERIVATIVES AS STAT6-MODULATORS, PREPARATION AND USE THEREOF AstraZeneca AB (SE) 2004-01-07 EP disclosed
WO-2002079165-A1 TETRAHYDROQUINOLINE DERIVATIVES AS STAT6-MODULATORS, PREPARATION AND USE THEREOF ASTRAZENECA AB (SE) 2002-10-10 WO disclosed