SCHEMBL3388966

SCHEMBL3388966

Cc1c(Br)c(OC(C)C)nn1C

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
SLC5A1 P13866 1/20 0.30
SLC5A2 P31639 1/20 0.30

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
SCHEMBL27296958 0.85 SMN1; SMN2 (0.32)
SCHEMBL3387939 0.76 SLC5A1 (0.30) SLC5A1SLC5A2
SCHEMBL24593558 0.72 NPC1 (0.31) CSNK2A1
SCHEMBL3260789 0.71 NPSR1 (0.45)
SCHEMBL14043734 0.69 CSNK2A1 (0.36) CSNK2A1
SCHEMBL30679115 0.69 CSNK2A1 (0.36) CSNK2A1
SCHEMBL3259325 0.68 MAPT (0.42)
SCHEMBL22436854 0.67 CSNK2A2 (0.37) CSNK2A2CSNK2BCSNK2A1
SCHEMBL17156232 0.67 ALDH1A1 (0.45)
SCHEMBL3262693 0.66 ATM (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010015657-A2 NEW ALKOXYPYRAZOLES INSTITUT PASTEUR (FR) 2010-02-11 WO disclosed
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed