SCHEMBL14878419

SCHEMBL14878419

NC(=O)[C@H]1CN(C(=O)c2cccnc2)CCN1S(=O)(=O)c1cc(F)c(Oc2ccc(Cl)cc2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 3/20 0.53
MMP9 P14780 3/20 0.53
MMP13 P45452 3/20 0.53
MMP3 P08254 2/20 0.53
MMP7 P09237 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.49
LMNA P02545 1/20 0.49
PKM P14618 1/20 0.43
POLB P06746 2/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 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
SCHEMBL12905490 0.92 MMP1 (0.51) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878468 0.91 MMP1 (0.41) MMP1MMP9MMP13MMP3MMP7
SCHEMBL778947 0.91 MMP1 (0.66) MMP1MMP9MMP13MMP3MMP7
SCHEMBL6851780 0.87 FNTA (0.46) MMP1MMP9MMP13MMP3MMP7
SCHEMBL16507897 0.86 MMP1 (0.64) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878420 0.85 MMP1 (0.51) MMP1MMP9MMP13MMP3MMP7
SCHEMBL12905437 0.83 MMP1 (0.40) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878438 0.81 CNR1 (0.38) MMP1MMP9MMP13MMP3MMP7
SCHEMBL778858 0.81 MMP1 (0.53) MMP1MMP9MMP13MMP3MMP7
SCHEMBL14878439 0.81 MMP3 (0.40) 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