SCHEMBL6689447

SCHEMBL6689447

CC1(C)[C@@H](OC(=O)NO)NC(=O)N1Cc1ccc(Oc2ccncc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 10/20 0.38
MMP2 P08253 6/20 0.38
MMP13 P45452 5/20 0.38
MMP3 P08254 4/20 0.38
MMP9 P14780 3/20 0.38
MMP7 P09237 2/20 0.36
MMP8 P22894 1/20 0.36
MMP14 P50281 1/20 0.36
ADAM17 P78536 1/20 0.36
P2RX3 P56373 6/20 0.35
ACACB O00763 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL6698909 0.89 S1PR5 (0.40) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6693912 0.88 MMP13 (0.50) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6703207 0.85 MMP13 (0.53) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6691917 0.83 MMP1 (0.43) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6689106 0.75 S1PR5 (0.41) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6691208 0.74 MMP1 (0.53) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6692070 0.74 MMP13 (0.51) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6690306 0.72 MMP1 (0.45) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6698129 0.71 MMP13 (0.48) MMP1MMP2MMP13MMP3MMP9
SCHEMBL6693880 0.71 MMP1 (0.57) MMP1MMP2MMP13MMP3MMP9

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