SCHEMBL5760409

SCHEMBL5760409

C[C@]1(O)CCCN(S(=O)(=O)c2ccc(OCc3nc4cc(C(F)(F)F)ccc4s3)cc2)[C@@H]1OC(=O)NO

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.48
ADAM17 P78536 9/20 0.48

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
SCHEMBL5757157 0.89 MMP1 (0.61) MMP1ADAM17
SCHEMBL5757615 0.88 MMP1 (0.54) MMP1ADAM17
SCHEMBL5761276 0.84 MMP1 (0.43) MMP1ADAM17
SCHEMBL5760182 0.80 ADAM17 (0.48) MMP1ADAM17
SCHEMBL6380696 0.80 MMP1 (0.59) MMP1ADAM17
SCHEMBL6384644 0.79 MMP1 (0.46) MMP1ADAM17
SCHEMBL8433497 0.79 MMP1 (0.43) MMP1ADAM17
SCHEMBL8433487 0.79 MMP1 (0.43) MMP1ADAM17
SCHEMBL8521422 0.78 AKR1B1 (0.40) MMP1ADAM17
SCHEMBL5761544 0.78 MMP1 (0.56) MMP1ADAM17

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