SCHEMBL6693372

SCHEMBL6693372

C[C@@]1(OC(=O)NO)CN(Cc2ccc(Oc3ccc(Cl)cc3)cc2)C(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.41
MMP13 P45452 10/20 0.41
MMP9 P14780 10/20 0.41
MMP2 P08253 7/20 0.41
MMP3 P08254 4/20 0.41
ADAM17 P78536 7/20 0.41
S1PR5 Q9H228 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
MMP7 P09237 2/20 0.40
MMP8 P22894 2/20 0.40
MMP14 P50281 2/20 0.40
ADAMTS4 O75173 1/20 0.40
ADAMTS5 Q9UNA0 1/20 0.40
ABCB11 O95342 1/20 0.39
MMP10 P09238 1/20 0.39
FAAH O00519 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 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
SCHEMBL6689488 0.90 MMP13 (0.53) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6689090 0.89 MMP1 (0.40) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6701978 0.87 MMP13 (0.56) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6691197 0.83 MMP1 (0.45) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6689122 0.81 EGLN1 (0.47) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6695530 0.77 MMP1 (0.40) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6693911 0.73 MMP13 (0.55) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6693872 0.72 MMP1 (0.42) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6693302 0.71 MMP13 (0.55) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6694302 0.70 MMP1 (0.44) MMP1MMP13MMP9MMP2MMP3

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-1134215-B1 2-oxo-imidazolidine-4-carboxylic acid hydroxamine compounds that inhibit matrix metalloproteinases PFIZER PROD INC (US) 2004-10-06 EP claimed