SCHEMBL2145134

SCHEMBL2145134

Cc1nccc(N)c1N1CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.42
ALDH1A1 P00352 5/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
HSD17B10 Q99714 3/20 0.42
CLK4 Q9HAZ1 2/20 0.42
USP2 O75604 2/20 0.42
ALOX15 P16050 2/20 0.42
CYP1A2 P05177 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
PIK3CA P42336 5/20 0.41
PIK3R1 P27986 2/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CB P42338 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
MTOR P42345 2/20 0.40
GAA P10253 3/20 0.40
MAPT P10636 3/20 0.40

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
Ammonia Solution, Strong SCHEMBL28610359 0.81 ALDH1A1 (0.45) LRRK2ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL26797380 0.77 LRRK2 (0.52) LRRK2ALDH1A1CYP1A2PIK3CAPIK3R1
SCHEMBL2711245 0.76 KDM4E (0.43) LRRK2ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL6854811 0.75 LGMN (0.47) ALDH1A1MEN1KMT2AHSD17B10USP2
SCHEMBL17583342 0.72 KDM4E (0.57) LRRK2ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL30622679 0.72 KDM4E (0.57) LRRK2ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL3723928 0.72 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AHSD17B10USP2
Hydrochloric Acid SCHEMBL10887133 0.71 PIK3CA (0.48) LRRK2ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL10076882 0.70 KDM4E (0.47) LRRK2ALDH1A1CYP1A2PIK3CAPIK3R1
SCHEMBL16856929 0.70 GAA (0.44) LRRK2ALDH1A1CYP1A2PIK3CAPIK3R1

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-2344494-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS Signal Pharmaceuticals, LLC (US) 2011-07-20 EP disclosed
WO-2010027500-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2010-03-11 WO disclosed