SCHEMBL5756496

SCHEMBL5756496

C[C@]1(O)CCCN(S(=O)(=O)c2ccc(OCc3ccc(F)cc3)cc2)[C@@H]1OC(=O)NO

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.75
ADAM17 P78536 9/20 0.75
ADAMTS4 O75173 1/20 0.57
TNF P01375 1/20 0.57
MMP2 P08253 1/20 0.57
MMP3 P08254 1/20 0.57
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
MMP13 P45452 1/20 0.57
MMP14 P50281 1/20 0.57
ADAMTS1 Q9UHI8 1/20 0.57
ADAMTS5 Q9UNA0 1/20 0.57

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
SCHEMBL5760551 0.90 MMP1 (0.75) MMP1ADAM17
SCHEMBL5758021 0.86 MMP1 (1.00) MMP1ADAM17ADAMTS4TNFMMP2
SCHEMBL5757881 0.86 MMP1 (1.00) MMP1ADAM17ADAMTS4TNFMMP2
SCHEMBL7507355 0.83 MMP1 (0.81) MMP1ADAM17ADAMTS4TNFMMP2
SCHEMBL5756703 0.83 MMP1 (0.81) MMP1ADAM17ADAMTS4TNFMMP2
SCHEMBL5760062 0.82 MMP1 (0.53) MMP1ADAM17
SCHEMBL5761544 0.81 MMP1 (0.56) MMP1ADAM17
SCHEMBL6239380 0.81 MMP1 (0.58) MMP1ADAM17MMP3MMP8MMP13
SCHEMBL5757615 0.80 MMP1 (0.54) MMP1ADAM17
SCHEMBL5760495 0.79 ADAM17 (0.61) MMP1ADAM17MMP3MMP8MMP13

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