SCHEMBL6695530

SCHEMBL6695530

CC1(C)N(Cc2ccc(Oc3ccc(Cl)cc3)cc2)C(=O)N[C@]1(C)OC(=O)NO

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 12/20 0.40
MMP9 P14780 9/20 0.40
MMP13 P45452 8/20 0.40
ADAM17 P78536 7/20 0.40
S1PR5 Q9H228 1/20 0.39
MMP2 P08253 5/20 0.38
MMP3 P08254 3/20 0.38
MMP7 P09237 2/20 0.38
MMP8 P22894 2/20 0.38
MMP14 P50281 2/20 0.38
ADAMTS4 O75173 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
FAAH O00519 1/20 0.36
P2RX3 P56373 2/20 0.35
ABCB11 O95342 1/20 0.35
MMP10 P09238 1/20 0.35
EGLN1 Q9GZT9 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
SCHEMBL6691004 0.90 MMP13 (0.46) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL6694302 0.83 MMP1 (0.44) MMP1MMP9MMP13ADAM17S1PR5
SCHEMBL6693372 0.77 MMP1 (0.41) MMP1MMP9MMP13ADAM17S1PR5
SCHEMBL6698909 0.75 S1PR5 (0.40) MMP1MMP9MMP13ADAM17S1PR5
SCHEMBL6690762 0.73 MMP13 (0.48) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL6690306 0.72 MMP1 (0.45) MMP1MMP9MMP13ADAM17S1PR5
SCHEMBL6691197 0.70 MMP1 (0.45) MMP1MMP9MMP13ADAM17S1PR5
SCHEMBL7862161 0.70 MMP1 (0.43) MMP1MMP9MMP13ADAM17S1PR5
SCHEMBL6689106 0.69 S1PR5 (0.41) MMP1MMP9MMP13ADAM17S1PR5
SCHEMBL6689488 0.67 MMP13 (0.53) MMP1MMP9MMP13ADAM17MMP2

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