SCHEMBL6443017

SCHEMBL6443017

CCCCCCCCC(Cc1ccccc1)N=O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.53
CNR2 P34972 1/20 0.44
MMP2 P08253 12/20 0.43
MMP1 P03956 7/20 0.43
MMP3 P08254 7/20 0.43
EPHX2 P34913 1/20 0.42
PKM P14618 1/20 0.42
MMP7 P09237 3/20 0.41

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
SCHEMBL6441532 1.00 CSNK1E (0.53) CSNK1ECNR2MMP2MMP1MMP3
SCHEMBL10439505 0.83 SIGMAR1 (0.45) CSNK1ECNR2
SCHEMBL29278764 0.83 SIGMAR1 (0.44)
SCHEMBL15572061 0.78 CYP1A2 (0.48) PKM
SCHEMBL28039887 0.77 CSNK1E (0.57) CSNK1ECNR2MMP2MMP1MMP3
SCHEMBL10821452 0.77 CSNK1E (0.57) CSNK1ECNR2MMP2MMP1MMP3
SCHEMBL8011984 0.77 CSNK1E (0.57) CSNK1ECNR2MMP2MMP1MMP3
SCHEMBL5586226 0.77 CSNK1E (0.57) CSNK1ECNR2MMP2MMP1MMP3
SCHEMBL8094331 0.77 CSNK1E (0.60) CSNK1ECNR2MMP2MMP1MMP3
SCHEMBL8094075 0.77 CSNK1E (0.60) CSNK1ECNR2MMP2MMP1MMP3

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-1185402-B1 AZOLE/AMINE OXIDE WOOD PRESERVATIVES AND FUNGICIDES LONZA AG (US) 2005-03-02 EP disclosed