SCHEMBL8420523

SCHEMBL8420523

CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
HCRTR1 O43613 1/20 0.51
MMP9 P14780 5/20 0.49
MMP8 P22894 5/20 0.49
NMBR P28336 3/20 0.49
MMP1 P03956 3/20 0.49
MMP3 P08254 2/20 0.49
TACR1 P25103 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ACE P12821 1/20 0.49
MMP2 P08253 3/20 0.49
TP53 P04637 3/20 0.48
TACR3 P29371 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
THRB P10828 1/20 0.48

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
SCHEMBL8422131 0.88 MMP9 (0.52) MEN1KMT2AHCRTR1MMP9MMP8
SCHEMBL8418339 0.88 MMP9 (0.52) MEN1KMT2AHCRTR1MMP9MMP8
SCHEMBL31506426 0.80 IL1RN (0.63) MEN1KMT2AHCRTR1MMP9MMP8
SCHEMBL25139560 0.79 MMP9 (0.70) MMP9MMP8MMP1MMP3MMP2
SCHEMBL21001592 0.79 KMT2A (0.76) MEN1KMT2AHCRTR1TACR1TP53
SCHEMBL21001593 0.79 KMT2A (0.76) MEN1KMT2AHCRTR1TACR1TP53
SCHEMBL8229351 0.79 MEN1 (0.54) MEN1KMT2AHCRTR1MMP9MMP8
SCHEMBL8221855 0.79 MEN1 (0.53) MEN1KMT2AHCRTR1MMP9MMP8
SCHEMBL8227146 0.79 MEN1 (0.53) MEN1KMT2AHCRTR1MMP9MMP8
SCHEMBL8221846 0.79 MEN1 (0.53) MEN1KMT2AHCRTR1MMP9MMP8

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 MEN1 1499/4885KMT2A 4489/4885HCRTR1 4550/4885

“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.