SCHEMBL14878469

SCHEMBL14878469

COCCN1CCN(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 17)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.42
FPR1 P21462 1/20 0.40
MMP1 P03956 5/20 0.40
MMP9 P14780 5/20 0.40
MMP13 P45452 5/20 0.40
MMP3 P08254 5/20 0.40
MMP7 P09237 4/20 0.40
HCRTR1 O43613 5/20 0.38
HCRTR2 O43614 5/20 0.38
F10 P00742 1/20 0.37
ADAM17 P78536 1/20 0.36
HTR7 P34969 1/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
FPR2 P25090 1/20 0.35
SCN9A Q15858 1/20 0.35
MMP8 P22894 2/20 0.35

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
SCHEMBL12905415 0.92 SOS1 (0.41) SOS1FPR1MMP1MMP9MMP13
SCHEMBL779126 0.90 MMP1 (0.52) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878404 0.87 ITGB1 (0.39) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878435 0.86 MMP9 (0.42) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878453 0.86 MMP1 (0.37) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878457 0.85 MDM2 (0.41) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878403 0.85 MMP3 (0.35) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878472 0.84 FPR2 (0.39) SOS1MMP1MMP9MMP13MMP3
SCHEMBL14878476 0.84 L3MBTL1 (0.39) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878449 0.83 MMP1 (0.38) MMP1MMP9MMP13MMP3MMP7

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
US-8426415-B2 Human ADAM-10 inhibitors SYMPHONY EVOLUTION, INC. (US) 2013-04-23 US disclosed