SCHEMBL7410002

SCHEMBL7410002

COc1ccc(-c2ccc(S(=O)(=O)NC3(C(=O)O)CCN(C(=O)O)CC3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 13/20 0.48
MMP1 P03956 11/20 0.48
MMP3 P08254 11/20 0.47
MMP9 P14780 10/20 0.47
MMP7 P09237 10/20 0.47
MMP2 P08253 10/20 0.47
MMP8 P22894 9/20 0.47
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.45
MEP1B Q16820 1/20 0.44
USP2 O75604 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL7253756 0.88 MMP1 (0.61) MMP13MMP1MMP3MMP9MMP7
SCHEMBL7250977 0.87 MMP13 (0.60) MMP13MMP1MMP3MMP9MMP7
SCHEMBL7250907 0.87 MMP13 (0.60) MMP13MMP1MMP3MMP9MMP7
SCHEMBL7255621 0.85 MMP13 (0.61) MMP13MMP1MMP3MMP9MMP7
SCHEMBL7252096 0.85 ALDH1A1 (0.59) MMP13MMP1MMP3MMP9MMP7
SCHEMBL7251763 0.84 MMP1 (0.52) MMP13MMP1MMP3MMP9MMP7
SCHEMBL7251813 0.83 MMP13 (0.55) MMP13MMP1MMP3MMP9MMP7
SCHEMBL6964392 0.82 MMP1 (0.56) MMP13MMP1MMP3MMP9MMP7
SCHEMBL5674362 0.81 USP2 (0.56) MMP13MMP1MMP3MMP9MMP7
SCHEMBL7251370 0.81 MMP1 (0.61) MMP13MMP1MMP3MMP9MMP2

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-1265863-A1 HETEROCYCLIC SIDE CHAIN CONTAINING METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-12-18 EP disclosed
WO-2001070690-A1 HETEROCYCLIC SIDE CHAIN CONTAINING METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2001-09-27 WO disclosed