SCHEMBL2466166

SCHEMBL2466166

Cn1cccc1C(=O)N1CCN(c2ccc(OC(=O)NCCC3CC3)nn2)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCD O00767 12/20 0.47
HPGDS O60760 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL2466295 0.85 SCD (0.52) SCD
SCHEMBL1377431 0.84 SCD (0.66) SCD
SCHEMBL2466234 0.83 SCD (0.57) SCD
SCHEMBL2466037 0.83 SCD (0.56) SCD
SCHEMBL2465681 0.82 SCD (0.51) SCD
SCHEMBL2470087 0.82 SCD (0.60) SCD
SCHEMBL2469951 0.82 SCD (0.48) SCD
SCHEMBL2470127 0.81 SCD (0.53) SCD
SCHEMBL2469380 0.80 SCD (0.48) SCD
SCHEMBL2466161 0.80 SCD (0.50) SCD

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
EP-1846035-B1 COMBINATION THERAPY XENON PHARMACEUTICALS INC (CA) 2011-09-21 EP claimed