SCHEMBL14167271

SCHEMBL14167271

CN(N)C(=O)CCC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL15247980 0.80 KDM4E (0.31)
SCHEMBL8570761 0.80 ALDH1A1 (0.48) ALDH1A1
SCHEMBL15794176 0.79 PHF8 (0.32)
SCHEMBL13644766 0.76 ALDH1A1 (0.30) ALDH1A1
SCHEMBL22021683 0.74 NAMPT (0.32)
SCHEMBL21341604 0.74 LMNA (0.34) ALDH1A1
SCHEMBL17615113 0.74 NPC1 (0.31)
SCHEMBL18018692 0.74 ALDH1A1 (0.46) ALDH1A1
SCHEMBL13407585 0.73 CHRNB2 (0.31)
SCHEMBL28057793 0.73 MEN1 (0.30)

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-2718266-A1 PYRIDIN- 2 -AMIDES USEFUL AS CB2 AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2014-04-16 EP disclosed
WO-2012168350-A1 PYRIDIN- 2 -AMIDES USEFUL AS CB2 AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2012-12-13 WO disclosed