SCHEMBL20414853

SCHEMBL20414853

CCCCCCCCCCCCCCCCCC(=O)NC(CCCCNC(=O)CCOCCOCCOCCOCCOCCNC(=O)CBr)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.69
▸ NOD1 Q9Y239 7/20 0.57
▸ EPHX2 P34913 2/20 0.51
▸ SLC6A5 Q9Y345 1/20 0.47
▸ FOLH1 Q04609 2/20 0.46

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
SCHEMBL23567382 1.00 GLP1R (0.69) GLP1RNOD1EPHX2SLC6A5FOLH1
SCHEMBL23567471 1.00 GLP1R (0.69) GLP1RNOD1EPHX2SLC6A5FOLH1
SCHEMBL18089385 1.00 GLP1R (0.69) GLP1RNOD1EPHX2SLC6A5FOLH1
SCHEMBL23567475 1.00 GLP1R (0.69) GLP1RNOD1EPHX2SLC6A5FOLH1
SCHEMBL16582429 1.00 GLP1R (0.69) GLP1RNOD1EPHX2SLC6A5FOLH1
SCHEMBL23567477 0.92 GLP1R (0.61) GLP1RNOD1EPHX2FOLH1
SCHEMBL24592948 0.92 GLP1R (0.61) GLP1RNOD1EPHX2FOLH1
SCHEMBL23567479 0.92 GLP1R (0.61) GLP1RNOD1EPHX2FOLH1
SCHEMBL23567375 0.92 GLP1R (0.61) GLP1RNOD1EPHX2FOLH1
SCHEMBL23567473 0.92 GLP1R (0.72) GLP1RNOD1EPHX2SLC6A5FOLH1

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-20180207276-A1 MODIFIED THERAPEUTIC AGENTS AND COMPOSITIONS THEREOF THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH 2018-07-26 — — 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-20180207276-A1 MODIFIED THERAPEUTIC AGENTS AND COMPOSITIONS THEREOF HDGF, ELANE, CD47 GLP1R 2845/4885NOD1 2428/4885EPHX2 1258/4885

“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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