SCHEMBL6920008

SCHEMBL6920008

CCn1nc(C2CC2)c(C(=O)c2cccnc2)c1O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 3/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
TRPV6 Q9H1D0 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL6920431 0.94 ALDH1A1 (0.41) L3MBTL1ALDH1A1GAAHTTMAPT
SCHEMBL6921157 0.84 ALDH1A1 (0.43) L3MBTL1ALDH1A1GAAHTTSMN1; SMN2
SCHEMBL6921278 0.81 TSHR (0.46) L3MBTL1ALDH1A1GAAHTTMAPT
SCHEMBL6922174 0.80 MAPT (0.43) L3MBTL1ALDH1A1GAAHTTMAPT
SCHEMBL6919504 0.80 ALDH1A1 (0.41) L3MBTL1ALDH1A1GAAHTTSMN1; SMN2
SCHEMBL6920224 0.79 ALDH1A1 (0.43) L3MBTL1ALDH1A1HTTSMN1; SMN2TSHR
SCHEMBL6920919 0.78 TBXAS1 (0.52) L3MBTL1ALDH1A1GAAHTTMAPT
SCHEMBL6922335 0.78 MAPT (0.41) L3MBTL1ALDH1A1GAAHTTMAPT
SCHEMBL6919541 0.78 HTT (0.41) L3MBTL1ALDH1A1GAAHTTMAPT
SCHEMBL6919643 0.77 L3MBTL1 (0.46) L3MBTL1ALDH1A1GAAHTTMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004033431-A2 HYDROXYPYRAZOLES FOR USE AGAINST METABOLIC-RELATED DISORDERS ARENA PHARMACEUTICALS, INC. (US) 2004-04-22 WO disclosed