SCHEMBL14878436

SCHEMBL14878436

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

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
MMP3 P08254 5/20 0.39
MMP1 P03956 4/20 0.39
MMP9 P14780 4/20 0.39
MMP7 P09237 3/20 0.39
MMP13 P45452 3/20 0.39
MMP8 P22894 2/20 0.38
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 2/20 0.37
ALDH1A1 P00352 6/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
F10 P00742 2/20 0.36
F2 P00734 1/20 0.36
SCN9A Q15858 1/20 0.36
LMNA P02545 2/20 0.36
MMP2 P08253 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
SCHEMBL12905432 0.91 ALDH1A1 (0.39) KMT2AMEN1MMP3MMP1MMP9
SCHEMBL14878480 0.91 MMP9 (0.47) KMT2AMMP3MMP1MMP9MMP7
SCHEMBL14878481 0.90 MMP3 (0.41) KMT2AMMP3MMP1MMP9MMP7
SCHEMBL779155 0.89 MMP1 (0.52) MMP3MMP1MMP9MMP7MMP13
SCHEMBL14878434 0.89 MMP1 (0.36) KMT2AMEN1MMP3MMP1MMP9
SCHEMBL14878453 0.85 MMP1 (0.37) KMT2AMEN1MMP3MMP1MMP9
SCHEMBL14878418 0.85 F10 (0.42) KMT2AMMP3MMP1MMP9MMP7
SCHEMBL14878402 0.84 ITGA4 (0.37) KMT2AMMP3MMP1MMP9MMP7
SCHEMBL14878401 0.84 KMT2A (0.41) KMT2AMMP3MMP1MMP9MMP7
SCHEMBL14878440 0.84 ALDH1A1 (0.37) KMT2AMMP3MMP1MMP9MMP7

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-1511488-B1 HUMAN ADAM-10 INHIBITORS SYMPHONY EVOLUTION INC (US) 2013-05-22 EP disclosed
US-8426415-B2 Human ADAM-10 inhibitors SYMPHONY EVOLUTION, INC. (US) 2013-04-23 US disclosed
EP-2436676-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-04-04 EP disclosed