SCHEMBL7950401

SCHEMBL7950401

NC(=O)C1(CS(=O)(=O)c2ccc(OCc3ccnc4ccccc34)cc2)CCN(O)CC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 3/20 0.50
ADAM17 P78536 12/20 0.48
MMP13 P45452 10/20 0.48
ADAMTS4 O75173 1/20 0.46
MMP2 P08253 4/20 0.44
MMP9 P14780 2/20 0.44

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
SCHEMBL7942802 0.94 MMP1 (0.44) MMP1ADAM17MMP13MMP2MMP9
SCHEMBL7951099 0.82 ADAM17 (0.46) MMP1ADAM17MMP13MMP2MMP9
SCHEMBL7354231 0.81 ADAM17 (0.62) MMP1ADAM17MMP13MMP2MMP9
SCHEMBL7362510 0.78 ADAM17 (0.58) MMP1ADAM17MMP13MMP2MMP9
SCHEMBL7353427 0.78 ADAM17 (0.57) MMP1ADAM17MMP13MMP2MMP9
SCHEMBL7421651 0.74 MMP1 (0.46) MMP1ADAM17MMP13ADAMTS4MMP2
SCHEMBL7358650 0.74 ADAM17 (0.61) MMP1ADAM17MMP13MMP2MMP9
SCHEMBL7952823 0.74 ADAM17 (0.48) MMP1ADAM17MMP13ADAMTS4MMP2
SCHEMBL7419988 0.74 ADAM17 (0.49) MMP1ADAM17MMP13ADAMTS4MMP2
SCHEMBL7430361 0.73 ADAM17 (0.45) MMP1ADAM17MMP13ADAMTS4MMP2

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-6268379-B1 Substituted aryl hydroxamic acids as metalloproteinase inhibitors DUPONT PHARMACEUTICALS COMPANY 2001-07-31 US claimed
US-6268379-B1 Substituted aryl hydroxamic acids as metalloproteinase inhibitors DUPONT PHARMACEUTICALS COMPANY 2001-07-31 US disclosed