SCHEMBL6985626

SCHEMBL6985626

CC(=O)Nc1cc(-c2ccc(=O)n(C(C)C)n2)n(-c2ccccc2)n1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 14/20 0.43
MAPT P10636 3/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 2/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AOC3 Q16853 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL6985081 0.90 SLC5A1 (0.42) SLC5A1MAPTKDM4ENPC1RAB9A
SCHEMBL6983748 0.89 GRM5 (0.46) SLC5A1SMN1; SMN2
SCHEMBL6979355 0.85 SOAT2 (0.42) SLC5A1
SCHEMBL6984285 0.82 PTGS2 (0.40) SLC5A1
SCHEMBL6986371 0.81 ALDH1A1 (0.41) NPC1RAB9ATSHRHTTTP53
SCHEMBL6987355 0.79 ALDH1A1 (0.38) MAPTKDM4ENPC1PKMRAB9A
SCHEMBL6986605 0.78 HTT (0.48) MAPTSMN1; SMN2TSHRHTT
SCHEMBL6986812 0.77 ALDH1A1 (0.40) MAPTNPC1RAB9ASMN1; SMN2TSHR
SCHEMBL6985846 0.76 BCL2 (0.41) SLC5A1MAPTSMN1; SMN2TSHRHTT
SCHEMBL6986113 0.76 AGTR2 (0.41) SMN1; SMN2HSD17B10TP53

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-1313733-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-28 EP disclosed
WO-2002018382-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-07 WO disclosed