SCHEMBL16590726

SCHEMBL16590726

CC(=O)[C@H](C(C)C)N(C)C(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCOCCOCCOCCOCCNC(=O)CCN2C(=O)C=CC2=O)C(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.47
▸ FOLH1 Q04609 2/20 0.36
▸ OPRK1 P41145 2/20 0.35
▸ MAP1LC3B Q9GZQ8 2/20 0.35
▸ TTR P02766 2/20 0.33
▸ GLP1R P43220 3/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ IL23R Q5VWK5 3/20 0.32
▸ SIRT2 Q8IXJ6 1/20 0.32
▸ SIRT1 Q96EB6 1/20 0.32

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
SCHEMBL16596164 0.99 FAP (0.47) FAPFOLH1OPRK1MAP1LC3BTTR
SCHEMBL16387730 0.93 FAP (0.47) FAPFOLH1OPRK1MAP1LC3BSIRT2
SCHEMBL17815405 0.91 FAP (0.42) FAPOPRK1MAP1LC3BSIRT2SIRT1
SCHEMBL23347041 0.91 FAP (0.42) FAPOPRK1MAP1LC3BSIRT2SIRT1
SCHEMBL22910385 0.91 FAP (0.42) FAPOPRK1MAP1LC3BSIRT2SIRT1
SCHEMBL23350883 0.91 FAP (0.42) FAPOPRK1MAP1LC3BSIRT2SIRT1
SCHEMBL17722953 0.91 FAP (0.42) FAPOPRK1MAP1LC3BSIRT2SIRT1
SCHEMBL23347004 0.91 FAP (0.42) FAPOPRK1MAP1LC3BSIRT2SIRT1
SCHEMBL19046497 0.91 FAP (0.42) FAPOPRK1MAP1LC3BSIRT2SIRT1
SCHEMBL14968423 0.90 FAP (0.48) FAPFOLH1MAP1LC3BTTRCYP3A4

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-20150087810-A1 Matrix Metalloproteinase Substrates And Other Cleavable Moieties And Methods Of Use Thereof CYTOMX THERAPEUTICS, INC. 2015-03-26 — — 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-20150087810-A1 Matrix Metalloproteinase Substrates And Other Cleavable Moieties And Methods Of Use Thereof ADAM33, MMP26, ADAM17 FAP 64/4885FOLH1 110/4885OPRK1 4619/4885

“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.

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