SCHEMBL7643934

SCHEMBL7643934

CCCC(NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1)P(=O)(O)CN(C(=O)CCCc1ccccc1)[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 10/20 0.48
MMP1 P03956 3/20 0.48
MMP2 P08253 3/20 0.47
CPA1 P15085 1/20 0.45
CPA2 P48052 1/20 0.45
CPA4 Q9UI42 1/20 0.45
ACE P12821 3/20 0.43
ERAP2 Q6P179 1/20 0.40
ERAP1 Q9NZ08 1/20 0.40
LNPEP Q9UIQ6 1/20 0.40
F2 P00734 1/20 0.37

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
SCHEMBL7401520 0.93 MMP3 (0.54) MMP3MMP1MMP2CPA1CPA2
SCHEMBL7402164 0.86 MMP3 (0.51) MMP3MMP1MMP2CPA1CPA2
SCHEMBL8343196 0.84 MMP3 (0.45) MMP3MMP1MMP2CPA1CPA2
SCHEMBL7643941 0.82 MMP3 (0.59) MMP3MMP1MMP2
SCHEMBL7401524 0.77 MMP3 (0.66) MMP3MMP1MMP2
SCHEMBL7397723 0.77 KDM4E (0.45) MMP3MMP1MMP2
SCHEMBL7391702 0.75 MMP3 (0.64) MMP3MMP1MMP2CPA1CPA2
SCHEMBL7402167 0.74 MMP3 (0.59) MMP3MMP1MMP2
SCHEMBL7396366 0.74 MMP3 (0.42) MMP3MMP2
SCHEMBL8858202 0.73 MMP3 (0.54) MMP3MMP1MMP2CPA1CPA2

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
US-6340709-B1 ADMINISTERING BIPHENYLSULFONAMIDE DERIVATIVE WARNER-LAMBERT COMPANY 2002-01-22 US disclosed