SCHEMBL8433487

SCHEMBL8433487

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

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 15/20 0.43
ADAM17 P78536 14/20 0.43
MMP13 P45452 9/20 0.43
HCRTR1 O43613 2/20 0.42
HCRTR2 O43614 2/20 0.42
KCNQ1 P51787 1/20 0.41

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
SCHEMBL8433497 1.00 MMP1 (0.43) MMP1ADAM17MMP13HCRTR1HCRTR2
SCHEMBL5760182 0.89 ADAM17 (0.48) MMP1ADAM17MMP13HCRTR1HCRTR2
SCHEMBL8436802 0.88 ADAM17 (0.49) MMP1ADAM17MMP13
SCHEMBL5761276 0.82 MMP1 (0.43) MMP1ADAM17HCRTR1HCRTR2KCNQ1
SCHEMBL5757157 0.82 MMP1 (0.61) MMP1ADAM17
SCHEMBL6380696 0.80 MMP1 (0.59) MMP1ADAM17MMP13
SCHEMBL5760409 0.79 MMP1 (0.48) MMP1ADAM17
SCHEMBL8573731 0.79 ADAM17 (0.51) MMP1ADAM17MMP13
SCHEMBL8573736 0.79 ADAM17 (0.51) MMP1ADAM17MMP13
SCHEMBL6384644 0.78 MMP1 (0.46) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0960098-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-12-01 EP disclosed
WO-1998034918-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-08-13 WO disclosed