SCHEMBL4790656

SCHEMBL4790656

[AsH2]c1ccccc1-c1cn2ccccc2n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 15/20 0.54
NPC1 O15118 14/20 0.54
KDM4E B2RXH2 10/20 0.54
ALDH1A1 P00352 8/20 0.54
SMN1; SMN2 Q16637 7/20 0.54
MAPT P10636 4/20 0.54
POLB P06746 2/20 0.54
HPGD P15428 2/20 0.54
PKM P14618 7/20 0.54
GFER P55789 2/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51
RELA Q04206 2/20 0.51
ALOX12 P18054 1/20 0.51
HDAC6 Q9UBN7 1/20 0.50
TLR9 Q9NR96 1/20 0.50
HTT P42858 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 1/20 0.50
EPHX2 P34913 1/20 0.49

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
SCHEMBL31731985 0.81 RAB9A (0.67) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL10978758 0.81 RAB9A (0.62) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL30714867 0.81 RAB9A (0.62) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL28880626 0.79 KDM4E (0.61) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL10333641 0.79 RAB9A (0.61) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL29080558 0.79 RAB9A (0.57) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL28407279 0.79 RAB9A (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL30558267 0.79 RAB9A (0.61) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL222164 0.79 RAB9A (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL30714904 0.79 RAB9A (0.54) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2

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-1910362-A1 IMIDAZOPYRIDINE DERIVATIVES AS SIRTUIN MODULATING AGENTS Sirtris Pharmaceuticals, Inc. (US) 2008-04-16 EP disclosed
WO-2007019345-A1 IMIDAZOPYRIDINE DERIVATIVES AS SIRTUIN MODULATING AGENTS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed