SCHEMBL14878435

SCHEMBL14878435

COCCOC(=O)N1CCN(S(=O)(=O)c2cc(F)c(Oc3ccc(Cl)cc3)c(F)c2)[C@@H](C(N)=O)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 11/20 0.42
MMP1 P03956 10/20 0.42
MMP3 P08254 9/20 0.42
MMP13 P45452 9/20 0.42
MMP7 P09237 8/20 0.42
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
MMP2 P08253 2/20 0.37
MMP8 P22894 2/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 2/20 0.37
ADAM17 P78536 2/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL14878456 0.93 MMP1 (0.43) MMP9MMP1MMP3MMP13MMP7
SCHEMBL12905331 0.92 MMP9 (0.41) MMP9MMP1MMP3MMP13MMP7
SCHEMBL12942841 0.92 MMP9 (0.44) MMP9MMP1MMP3MMP13MMP7
SCHEMBL14878484 0.92 MMP3 (0.44) MMP9MMP1MMP3MMP13MMP7
SCHEMBL12905327 0.91 MMP9 (0.41) MMP9MMP1MMP3MMP13MMP7
SCHEMBL14878464 0.90 MMP9 (0.43) MMP9MMP1MMP3MMP13MMP7
SCHEMBL328472 0.90 MMP1 (0.54) MMP9MMP1MMP3MMP13MMP7
SCHEMBL918708 0.90 MMP1 (0.54) MMP9MMP1MMP3MMP13MMP7
SCHEMBL919124 0.90 MMP1 (0.53) MMP9MMP1MMP3MMP13MMP7
SCHEMBL919122 0.90 MMP1 (0.53) MMP9MMP1MMP3MMP13MMP7

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
WO-2014028334-A1 SELECTIVE MMP INHIBITORS SYMPHONY EVOLUTION, INC. (US) 2014-02-20 WO disclosed
US-8426415-B2 Human ADAM-10 inhibitors SYMPHONY EVOLUTION, INC. (US) 2013-04-23 US disclosed