SCHEMBL14878423

SCHEMBL14878423

NC(=O)[C@H]1CN(C(=O)N2CCOCC2)CCN1S(=O)(=O)c1ccc(-c2cccc(F)c2)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.44
MMP3 P08254 1/20 0.44
MMP7 P09237 1/20 0.44
MMP9 P14780 1/20 0.44
MMP13 P45452 1/20 0.44
PKM P14618 1/20 0.42
PTGS2 P35354 1/20 0.42
HPGDS O60760 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
GRIN2B Q13224 1/20 0.39
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MAP3K7 O43318 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
WNT3A P56704 2/20 0.36
ALDH1A1 P00352 2/20 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
SCHEMBL12905488 0.91 MMP1 (0.44) MMP1MMP3MMP7MMP9MMP13
SCHEMBL779058 0.90 MMP1 (0.57) MMP1MMP3MMP7MMP9MMP13
SCHEMBL14878483 0.80 F2R (0.41) MMP1MMP3MMP7MMP9MMP13
SCHEMBL14878463 0.76 MMP1 (0.60) MMP1MMP3MMP7MMP9MMP13
SCHEMBL12905511 0.73 F2R (0.41) MMP1MMP3MMP7MMP9MMP13
SCHEMBL14878452 0.72 MMP1 (0.51) MMP1MMP3MMP7MMP9MMP13
SCHEMBL14878430 0.72 MMP1 (0.51) MMP1MMP3MMP7MMP9MMP13
SCHEMBL328559 0.71 MMP1 (0.50) MMP1MMP3MMP7MMP9MMP13
SCHEMBL14878451 0.69 MMP1 (0.50) MMP1MMP3MMP7MMP9MMP13
SCHEMBL14878478 0.69 MMP1 (0.49) MMP1MMP3MMP7MMP9MMP13

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