SCHEMBL6698909

SCHEMBL6698909

CC1(C)[C@@H](OC(=O)NO)NC(=O)N1Cc1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 1/20 0.40
MMP1 P03956 12/20 0.39
MMP9 P14780 11/20 0.39
MMP13 P45452 10/20 0.39
MMP2 P08253 8/20 0.39
ADAM17 P78536 7/20 0.39
MMP3 P08254 4/20 0.39
MMP8 P22894 3/20 0.38
MMP14 P50281 3/20 0.38
MMP7 P09237 2/20 0.38
ADAMTS4 O75173 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
ABCB11 O95342 1/20 0.36
MMP10 P09238 1/20 0.36
LTA4H P09960 1/20 0.36
EPHX2 P34913 1/20 0.36
MMP12 P39900 1/20 0.36
FAAH O00519 1/20 0.35

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
SCHEMBL6693912 0.90 MMP13 (0.50) MMP1MMP9MMP13MMP2ADAM17
SCHEMBL6689447 0.89 MMP1 (0.38) MMP1MMP9MMP13MMP2ADAM17
SCHEMBL6703207 0.87 MMP13 (0.53) MMP1MMP9MMP13MMP2ADAM17
SCHEMBL6689106 0.85 S1PR5 (0.41) S1PR5MMP1MMP9MMP13MMP2
SCHEMBL6690306 0.82 MMP1 (0.45) S1PR5MMP1MMP9MMP13MMP2
SCHEMBL6692070 0.76 MMP13 (0.51) MMP1MMP9MMP13MMP2ADAM17
SCHEMBL6695530 0.75 MMP1 (0.40) S1PR5MMP1MMP9MMP13MMP2
SCHEMBL6693302 0.73 MMP13 (0.55) S1PR5MMP1MMP9MMP13MMP2
SCHEMBL6698129 0.73 MMP13 (0.48) MMP1MMP9MMP13MMP2ADAM17
SCHEMBL6694302 0.73 MMP1 (0.44) S1PR5MMP1MMP9MMP13MMP2

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