SCHEMBL6585885

SCHEMBL6585885

C=CC[C@@H](C(=O)NO)S(=O)(=O)N1CC=C(c2ccc(-c3ccccc3)c(C)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.66
MMP3 P08254 12/20 0.66
L3MBTL1 Q9Y468 1/20 0.42
NAMPT P43490 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
USP5 P45974 1/20 0.37

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
SCHEMBL6585875 1.00 MMP2 (0.66) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6585881 1.00 MMP2 (0.66) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6590816 0.91 MMP2 (0.62) MMP2MMP3L3MBTL1NAMPTKMT2A
SCHEMBL6588498 0.90 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6588492 0.90 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6588495 0.90 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6586544 0.89 MMP2 (0.59) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6586552 0.89 MMP2 (0.59) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6586549 0.89 MMP2 (0.59) MMP2MMP3L3MBTL1NAMPTKDM4E
SCHEMBL6587784 0.85 MMP2 (0.65) MMP2MMP3L3MBTL1NAMPTKDM4E

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
EP-1036062-B1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LTD (GB) 2004-01-02 EP disclosed
US-6495568-B1 TREATMENT OF TISSUE ULCERATION, WOUND REPAIR AND SKIN DISEASES WARNER-LAMBERT COMPANY 2002-12-17 US disclosed