SCHEMBL5693397

SCHEMBL5693397

CCNC(=O)C(C)=CCCN

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 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
SCHEMBL5693583 0.89 PAOX (0.37) PAOX
SCHEMBL27839074 0.82 MMP1 (0.31) MMP1MMP2MMP3MMP9MMP8
SCHEMBL5693430 0.79
SCHEMBL647032 0.77 EP300 (0.48)
Ammonia Solution, Strong SCHEMBL26087349 0.77 MMP1 (0.33) MMP1MMP2MMP3MMP9MMP8
SCHEMBL7144120 0.77 CYP2C9 (0.37)
SCHEMBL10571995 0.74 KMT2A (0.39)
SCHEMBL10572002 0.74 KMT2A (0.39)
SCHEMBL10645205 0.74 KMT2A (0.39)
SCHEMBL10645188 0.74 KMT2A (0.39)

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
EP-1487882-B1 BASE POLYMER OBTAINED BY HYDROGENATION STOCKHAUSEN CHEM FAB GMBH (DE) 2006-05-24 EP disclosed
EP-1487882-A1 BASE POLYMER OBTAINED BY HYDROGENATION Stockhausen GmbH (DE) 2004-12-22 EP disclosed
WO-2003080682-A1 BASE POLYMER OBTAINED BY HYDROGENATION STOCKHAUSEN GMBH (DE) 2003-10-02 WO disclosed