SCHEMBL3433557

SCHEMBL3433557

[c]1ccnc(-c2ccc3nc(-c4cnc5[nH]ccc5c4)cn3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.43
CDK8 P49336 8/20 0.42
AXL P30530 2/20 0.42
PIK3CA P42336 2/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
RIPK1 Q13546 4/20 0.41
NUDT1 P36639 1/20 0.39
CDK7 P50613 2/20 0.38
PLK4 O00444 2/20 0.38
ROCK2 O75116 2/20 0.38
PRKD3 O94806 2/20 0.38
MAP4K4 O95819 2/20 0.38
INSR P06213 2/20 0.38
CDK1 P06493 2/20 0.38
ROS1 P08922 2/20 0.38
FER P16591 2/20 0.38
CDK2 P24941 2/20 0.38
MARK3 P27448 2/20 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
SCHEMBL216667 0.79 CDK8 (0.50) LRRK2CDK8AXLPIK3CAPIK3CD
SCHEMBL3431534 0.75 CDK8 (0.68) LRRK2CDK8AXLCDK7PLK4
SCHEMBL217433 0.72 LRRK2 (0.46) LRRK2CDK8AXLPIK3CAPIK3CD
SCHEMBL27699368 0.69 CDK8 (0.67) LRRK2CDK8AXLPIK3CAPIK3CD
SCHEMBL4831566 0.68 CDK8 (0.66) LRRK2CDK8AXLPIK3CAPIK3CD
SCHEMBL16720139 0.67 ADORA2A (0.42) CDK8PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL12807118 0.67 PIK3CD (0.66) LRRK2CDK8AXLPIK3CAPIK3CD
SCHEMBL4831501 0.65 CDK8 (0.81) LRRK2CDK8AXLPIK3CAPIK3CD
SCHEMBL3431579 0.64 ALDH1A3 (0.49) LRRK2PLK4KDRCDK5ALDH1A2
SCHEMBL4006504 0.63 CYP1A2 (0.47) ALDH1A1

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-2262804-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- A] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-aventis (FR) 2010-12-22 EP disclosed
WO-2009144392-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- Α] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-12-03 WO disclosed