SCHEMBL5670486

SCHEMBL5670486

CCCC(NC1CCCCC1)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
EPHX1 P07099 12/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
EPHX2 P34913 4/20 0.37
THRB P10828 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL5130748 0.84 SMN1; SMN2 (0.53) SMN1; SMN2EPHX1KDM4EALDH1A1EPHX2
SCHEMBL5130749 0.84 SMN1; SMN2 (0.53) SMN1; SMN2EPHX1KDM4EALDH1A1EPHX2
SCHEMBL19753551 0.82 SMN1; SMN2 (0.50) SMN1; SMN2EPHX1KDM4EALDH1A1
SCHEMBL15384058 0.82 SMN1; SMN2 (0.50) SMN1; SMN2EPHX1KDM4EALDH1A1
SCHEMBL19753546 0.82 SMN1; SMN2 (0.41) SMN1; SMN2EPHX1KDM4EALDH1A1EPHX2
SCHEMBL2254202 0.81 ALDH1A1 (0.46) SMN1; SMN2EPHX1ALDH1A1EPHX2
SCHEMBL2244920 0.81 ALDH1A1 (0.46) SMN1; SMN2EPHX1ALDH1A1EPHX2
SCHEMBL24107359 0.81 EPHX1 (0.41) SMN1; SMN2EPHX1EPHX2
SCHEMBL15414684 0.80 EPHX1 (0.39) EPHX1KDM4EALDH1A1EPHX2THRB
SCHEMBL2247729 0.79 ALDH1A1 (0.43) SMN1; SMN2EPHX1ALDH1A1EPHX2

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-1729755-A1 METHODS OF TREATMENT OF AMYLOIDOSIS USING ASPARTYL-PROTEASE INIHIBITORS ELAN PHARMACEUTICALS, INC. (US) 2006-12-13 EP disclosed
WO-2005070407-A1 METHODS OF TREATMENT OF AMYLOIDOSIS USING ASPARTYL-PROTEASE INIHIBITORS ELAN PHARMACEUTICALS, INC. (US) 2005-08-04 WO disclosed