SCHEMBL5349571

SCHEMBL5349571

CC[C@]1(CS(=O)(=O)N2CCC(Oc3ccc(OC(F)(F)C(F)C(F)F)cc3)CC2)NC(=O)NC1=O

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.69
MMP14 P50281 10/20 0.69
KCNH2 Q12809 1/20 0.69
MMP12 P39900 5/20 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
SCHEMBL74550 0.95 MMP13 (0.77) MMP13MMP14KCNH2MMP12
SCHEMBL74331 0.88 MMP13 (0.77) MMP13MMP14KCNH2MMP12
SCHEMBL74330 0.88 MMP13 (0.77) MMP13MMP14KCNH2MMP12
SCHEMBL74593 0.85 MMP13 (0.78) MMP13MMP14KCNH2MMP12
SCHEMBL74255 0.85 MMP13 (0.77) MMP13MMP14KCNH2MMP12
SCHEMBL88026 0.85 MMP13 (0.77) MMP13MMP14KCNH2MMP12
SCHEMBL74232 0.83 MMP13 (0.77) MMP13MMP14KCNH2MMP12
SCHEMBL77273 0.82 MMP13 (1.00) MMP13MMP14KCNH2MMP12
SCHEMBL76108 0.81 MMP13 (0.71) MMP13MMP14KCNH2MMP12
SCHEMBL3960424 0.77 MMP13 (0.61) MMP13MMP14KCNH2MMP12

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-1828166-A1 HYDANTOIN DERIVATIVES USEFUL AS METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2007-09-05 EP disclosed
WO-2006064218-A1 HYDANTOIN DERIVATIVES USEFUL AS METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 WO disclosed