SCHEMBL14479332

SCHEMBL14479332

CCCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](C)CO)[C@@H](C)O)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 1/20 0.53
▸ GCGR P47871 1/20 0.53
▸ GIPR P48546 1/20 0.53
▸ IL23R Q5VWK5 8/20 0.52
▸ NPY4R P50391 7/20 0.49
▸ NPY1R P25929 6/20 0.49
▸ NPY2R P49146 6/20 0.49
▸ NPY5R Q15761 6/20 0.49
▸ BCL2L1 Q07817 1/20 0.47
▸ BAD Q92934 1/20 0.47
▸ TFPI P10646 1/20 0.47

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
SCHEMBL14479381 0.94 GLP1R (0.54) GLP1RGCGRGIPRIL23RNPY4R
SCHEMBL14479348 0.92 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5RTFPI
SCHEMBL14479452 0.92 GLP1R (0.58) GLP1RGCGRGIPRIL23RNPY4R
SCHEMBL14479398 0.90 VIPR2 (0.51) GLP1RGCGRGIPRIL23RNPY4R
SCHEMBL14479351 0.90 GLP1R (0.56) GLP1RGCGRGIPRIL23RNPY4R
SCHEMBL14479349 0.90 GLP1R (0.56) GLP1RGCGRGIPRIL23RNPY4R
SCHEMBL14479340 0.90 GLP1R (0.56) GLP1RGCGRGIPRIL23RNPY4R
SCHEMBL16976099 0.90 GLP1R (0.57) GLP1RGCGRGIPRIL23RNPY4R
SCHEMBL16976144 0.90 NPY4R (0.60) IL23RNPY4RNPY1RNPY2RNPY5R
SCHEMBL16976126 0.90 GLP1R (0.57) GLP1RGCGRGIPRIL23RNPY4R

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-9155795-B2 CXCR4 receptor compounds ANCHOR THERAPEUTICS, INC. (US) 2015-10-13 — — US disclosed
US-20130005944-A1 CXCR4 Receptor Compounds ACER THERAPEUTICS INC. 2013-01-03 — — 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-20130005944-A1 CXCR4 Receptor Compounds CXCL12, CXCR4, CCR5 GLP1R 85/4885GCGR 94/4885GIPR 106/4885

“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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