SCHEMBL14878437

SCHEMBL14878437

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
MMP1 P03956 7/20 0.43
MMP9 P14780 6/20 0.43
MMP3 P08254 5/20 0.43
MMP7 P09237 5/20 0.43
MMP13 P45452 5/20 0.43
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
USP2 O75604 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RAB9A P51151 1/20 0.39
HTT P42858 1/20 0.39
ALOX15 P16050 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
SCHEMBL14878456 0.91 MMP1 (0.43) ALDH1A1MMP1MMP9MMP3MMP7
SCHEMBL12905374 0.91 ALDH1A1 (0.43) ALDH1A1MMP1MMP9MMP3MMP7
SCHEMBL778784 0.89 MMP1 (0.56) MMP1MMP9MMP3MMP7MMP13
SCHEMBL14878455 0.88 MMP1 (0.52) MMP1MMP9MMP3MMP7MMP13
SCHEMBL14878441 0.85 SCN9A (0.49) MMP1MMP9MMP3MMP7MMP13
SCHEMBL14878477 0.85 POLB (0.43) ALDH1A1LMNAKMT2APKMSMN1; SMN2
SCHEMBL14878435 0.84 MMP9 (0.42) MMP1MMP9MMP3MMP7MMP13
SCHEMBL14878484 0.84 MMP3 (0.44) ALDH1A1MMP1MMP9MMP3MMP7
SCHEMBL14878430 0.83 MMP1 (0.51) MMP1MMP9MMP3MMP7MMP13
SCHEMBL12905366 0.83 MMP1 (0.42) ALDH1A1MMP1MMP9MMP3MMP7

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
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