SCHEMBL6586479

SCHEMBL6586479

C=CC[C@H](C(=O)OC)S(=O)(=O)N1CC=C(c2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.53
MMP3 P08254 9/20 0.53
NAMPT P43490 1/20 0.45
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
USP5 P45974 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.40
HSD11B1 P28845 2/20 0.39
MMP14 P50281 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
KMT2A Q03164 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
SCHEMBL6586482 1.00 MMP2 (0.53) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6586474 1.00 MMP2 (0.53) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6588498 0.90 MMP2 (0.61) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6588492 0.90 MMP2 (0.61) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6588495 0.90 MMP2 (0.61) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6586549 0.87 MMP2 (0.59) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6586552 0.87 MMP2 (0.59) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6586544 0.87 MMP2 (0.59) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6586010 0.86 MMP2 (0.53) MMP2MMP3NAMPTALDH1A1PKM
SCHEMBL6586006 0.86 MMP2 (0.53) MMP2MMP3NAMPTALDH1A1PKM

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
EP-1036062-B1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LTD (GB) 2004-01-02 EP disclosed