SCHEMBL9277673

SCHEMBL9277673

CCCCCCCCC(O)C#Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.51
MMP9 P14780 2/20 0.51
MMP12 P39900 2/20 0.51
CSNK1E P49674 1/20 0.46
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HMGCR P04035 1/20 0.40
KCNH2 Q12809 1/20 0.40
ASAH1 Q13510 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.39
GPR84 Q9NQS5 3/20 0.39
FFAR1 O14842 1/20 0.39
NAAA Q02083 2/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL30669395 1.00 MMP2 (0.51) MMP2MMP9MMP12CSNK1ENPC1
SCHEMBL6744835 0.98 MMP2 (0.49) MMP2MMP9MMP12CSNK1ENPC1
SCHEMBL12003637 0.93 MMP12 (0.43) MMP2MMP9MMP12CSNK1ENPC1
SCHEMBL614604 0.87 KMT2A (0.42) MMP2MMP9MMP12NPC1RAB9A
Tetrabuthylammonium SCHEMBL29130286 0.86 MMP2 (0.44) MMP2MMP9MMP12CSNK1ENPC1
Tetrabuthylammonium SCHEMBL29130287 0.85 MMP2 (0.44) MMP2MMP9MMP12CSNK1ENPC1
SCHEMBL5804621 0.83 CSNK1E (0.48) MMP2MMP9MMP12CSNK1EKCNH2
SCHEMBL29144869 0.83 APP (0.37) MMP2MMP9MMP12KMT2AALDH1A1
SCHEMBL28070914 0.81 MMP2 (0.47) MMP2MMP9MMP12CSNK1EKCNH2
SCHEMBL29144879 0.81 MAPT (0.38) MMP2MMP9MMP12SMN1; SMN2KMT2A

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-0216624-B1 Pesticidal compounds ROUSSEL UCLAF (FR) 1995-02-22 EP disclosed