SCHEMBL27547263

SCHEMBL27547263

COc1ccc(S(=O)(=O)N2Cc3ccccc3N(C(C)=O)CC2C(=O)NO)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 1.00
MMP13 P45452 20/20 1.00
ADAM17 P78536 19/20 1.00
MMP9 P14780 19/20 1.00
MMP3 P08254 1/20 0.62
MMP7 P09237 1/20 0.62

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
SCHEMBL5657799 0.90 MMP1 (0.82) MMP1MMP13ADAM17MMP9
SCHEMBL27547254 0.90 MMP1 (0.85) MMP1MMP13ADAM17MMP9MMP3
SCHEMBL6614299 0.89 MMP1 (0.80) MMP1MMP13ADAM17MMP9
Dimethylamine SCHEMBL7424112 0.88 MMP1 (0.79) MMP1MMP13ADAM17MMP9
Dimethylamine SCHEMBL6642543 0.88 MMP1 (0.79) MMP1MMP13ADAM17MMP9
SCHEMBL27537608 0.87 MMP1 (0.84) MMP1MMP13ADAM17MMP9
SCHEMBL27521569 0.87 MMP1 (0.82) MMP1MMP13ADAM17MMP9
SCHEMBL27547261 0.86 MMP1 (0.75) MMP1MMP13ADAM17MMP9MMP3
SCHEMBL3939993 0.86 MMP13 (1.00) MMP1MMP13ADAM17MMP9
SCHEMBL27547259 0.86 MMP1 (0.79) MMP1MMP13ADAM17MMP9MMP3

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
CN-1293663-A 2,3,4,5-tetrahydro-1H-[1,4] benzodiazepine-3-hydroxamix acids as matrix metal-protease AMERICAN CYANAMID CO (US) 2001-05-02 CN claimed