SCHEMBL14075992

SCHEMBL14075992

C[C@]1(CS(=O)(=O)N2CCC(C(=O)c3ccccc3)CC2)NC(=O)NC1=O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.57
MMP14 P50281 8/20 0.57
MMP12 P39900 5/20 0.55
KCNH2 Q12809 1/20 0.50

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
SCHEMBL941781 0.89 MMP13 (0.67) MMP13MMP14MMP12KCNH2
SCHEMBL5035908 0.85 MMP13 (0.56) MMP13MMP14MMP12KCNH2
SCHEMBL5035910 0.85 MMP13 (0.56) MMP13MMP14MMP12KCNH2
SCHEMBL942608 0.84 MMP13 (0.55) MMP13MMP14MMP12
SCHEMBL941507 0.80 MMP13 (0.64) MMP13MMP14MMP12
SCHEMBL941464 0.79 MMP13 (0.81) MMP13MMP14MMP12KCNH2
SCHEMBL12911650 0.76 MMP13 (0.63) MMP13MMP14MMP12KCNH2
SCHEMBL943181 0.76 MMP13 (0.60) MMP13MMP14MMP12KCNH2
SCHEMBL942583 0.74 MMP13 (0.58) MMP13MMP14MMP12KCNH2
SCHEMBL941035 0.74 MMP13 (0.63) MMP13MMP14MMP12KCNH2

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
US-7427631-B2 especially as inhibitors of MMP12 ASTRAZENECA AB (SE) 2008-09-23 US disclosed
US-7427631-B2 especially as inhibitors of MMP12 ASTRAZENECA AB (SE) 2008-09-23 US disclosed