SCHEMBL15544467

SCHEMBL15544467

NC1CCCN(c2cccc(-n3ncc4cnc(-c5cncs5)cc43)n2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 20/20 1.00
PIM3 Q86V86 18/20 1.00
PIM2 Q9P1W9 18/20 1.00

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
SCHEMBL15401492 1.00 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15400461 0.84 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15544275 0.84 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15400154 0.83 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15543927 0.83 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15400744 0.81 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15400384 0.81 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15544510 0.80 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15401232 0.80 PIM1 (1.00) PIM1PIM3PIM2
SCHEMBL15401800 0.80 PIM1 (1.00) PIM1PIM3PIM2

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-2867232-A1 5-AZAINDAZOLE COMPOUNDS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2015-05-06 EP disclosed
WO-2014001377-A1 5-AZAINDAZOLE COMPOUNDS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2014-01-03 WO disclosed