SCHEMBL8415705

SCHEMBL8415705

CCC(=O)NC(C(=O)N[C@H](CC(N)=O)C(=O)OCc1ccc([N+](=O)[O-])cc1)c1c[nH]c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.42
MMP1 P03956 1/20 0.40
MMP14 P50281 1/20 0.40
IL1RN P18510 2/20 0.39
ERAP2 Q6P179 2/20 0.39
ERAP1 Q9NZ08 2/20 0.39
LNPEP Q9UIQ6 1/20 0.39
TACR1 P25103 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38

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
SCHEMBL8415721 1.00 MMP2 (0.42) MMP2MMP1MMP14IL1RNERAP2
SCHEMBL8418352 0.81 ACE (0.46) MEN1KMT2AMAPTMGAMGAA
SCHEMBL8415706 0.81 ACE (0.46) MEN1KMT2AMAPTMGAMGAA
SCHEMBL8420365 0.79 MMP9 (0.39) MMP2MMP1IL1RNERAP2ERAP1
SCHEMBL8418341 0.79 MMP9 (0.39) MMP2MMP1IL1RNERAP2ERAP1
SCHEMBL8354795 0.78 MMP2 (0.52) MMP2MMP1MMP14IL1RNERAP2
SCHEMBL8227038 0.78 BMP1 (0.51) MMP2MMP1MMP14IL1RNERAP2
SCHEMBL8221838 0.78 BMP1 (0.51) MMP2MMP1MMP14IL1RNERAP2
SCHEMBL14446077 0.77 LNPEP (0.49) MMP2MMP1MMP14IL1RNERAP2
SCHEMBL14446810 0.77 LNPEP (0.49) MMP2MMP1MMP14IL1RNERAP2

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-7335726-B2 Lipopeptide stereoisomers, methods for preparing same and useful intermediates CUBIST PHARMACEUTICALS, INC. (US) 2008-02-26 US disclosed
US-20060223983-A1 Lipopeptide stereoisomers, methods for preparing same and useful intermediates CUBIST PHARMACEUTICALS, INC. 2006-10-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060223983-A1 Lipopeptide stereoisomers, methods for preparing same and useful intermediates NGLY1, LSS, NRDC MMP2 2666/4885MMP1 3776/4885MMP14 2133/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.