SCHEMBL5759504

SCHEMBL5759504

O=C(NO)O[C@@H]1C[C@@H](O)CCN1S(=O)(=O)c1ccc(OCc2ccc(F)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 14/20 0.74
MMP1 P03956 17/20 0.61
MMP13 P45452 1/20 0.54
MMP8 P22894 2/20 0.53
MMP3 P08254 1/20 0.53

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
SCHEMBL5757940 1.00 ADAM17 (0.74) ADAM17MMP1MMP13MMP8MMP3
SCHEMBL5759840 0.91 ADAM17 (0.73) ADAM17MMP1MMP13MMP3
SCHEMBL5761185 0.91 ADAM17 (0.73) ADAM17MMP1MMP13MMP3
SCHEMBL5760266 0.86 ADAM17 (0.61) ADAM17MMP1MMP13MMP8MMP3
SCHEMBL5758235 0.86 ADAM17 (0.61) ADAM17MMP1MMP13MMP8MMP3
SCHEMBL5757113 0.85 ADAM17 (1.00) ADAM17MMP1MMP13MMP8MMP3
SCHEMBL5757960 0.85 ADAM17 (1.00) ADAM17MMP1MMP13MMP8MMP3
SCHEMBL5757799 0.85 ADAM17 (1.00) ADAM17MMP1MMP13MMP8MMP3
SCHEMBL27573313 0.82 ADAM17 (0.80) ADAM17MMP1MMP13MMP8MMP3
SCHEMBL5758209 0.82 ADAM17 (0.80) ADAM17MMP1MMP13MMP8MMP3

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-1104403-B1 HYDROXY PIPECOLATE HYDROXAMIC ACID DERIVATIVES AS MMP INHIBITORS PFIZER PROD INC (US) 2006-05-10 EP claimed