SCHEMBL3470490

SCHEMBL3470490

Clc1cn2ccncc2n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.42
DYRK1A Q13627 2/20 0.38
CLK1 P49759 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
BRAF P15056 2/20 0.33
ROCK1 Q13464 1/20 0.33
APP P05067 1/20 0.31

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
SCHEMBL6276392 0.75 HRH4 (0.42) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL12777861 0.75 HRH4 (0.42) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL4400860 0.75 HRH4 (0.45) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL31361318 0.75 HRH4 (0.39) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL9966056 0.75 DRD2 (0.47) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL25246071 0.72 HRH4 (0.40) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL22607307 0.71 HRH4 (0.42) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL29493481 0.71 HRH4 (0.39) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL11037075 0.71 HRH4 (0.42) HRH4DYRK1ACLK1DRD2DRD4
SCHEMBL12223303 0.71 DRD2 (0.47) HRH4DYRK1ACLK1DRD2DRD4

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-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO disclosed