SCHEMBL29707518

SCHEMBL29707518

CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.61
▸ IL23R Q5VWK5 1/20 0.60
▸ TACR1 P25103 1/20 0.59
▸ CXCR4 P61073 5/20 0.57
▸ GLP1R P43220 9/20 0.56
▸ GIPR P48546 9/20 0.56
▸ NPY1R P25929 1/20 0.54
▸ NPY2R P49146 1/20 0.54
▸ NPY4R P50391 1/20 0.54
▸ NPY5R Q15761 1/20 0.54

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
SCHEMBL31119411 1.00 C5AR1 (0.61) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL29707516 0.97 C5AR1 (0.61) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL29707517 0.97 C5AR1 (0.61) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL29707519 0.97 C5AR1 (0.56) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL29707524 0.96 C5AR1 (0.56) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL30644036 0.86 GLP1R (0.63) CXCR4GLP1RGIPR
SCHEMBL31182499 0.86 CXCR4 (0.60) CXCR4GLP1RGIPRNPY1RNPY2R
SCHEMBL29855927 0.86 CXCR4 (0.66) CXCR4GLP1RGIPRNPY1RNPY2R
SCHEMBL38662670 0.85 CXCR4 (0.62) C5AR1TACR1CXCR4
SCHEMBL31703183 0.84 GLP1R (0.69) GLP1RGIPR

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-20240299566-A1 POLY-ARGININE DERIVATIVES FOR ENHANCING BRAIN-DERIVED GROWTH FACTOR TO MITIGATE NEUROLOGICAL DISORDERS BROWN UNIVERSITY 2024-09-12 — — US disclosed
WO-2022150362-A1 POLY-ARGININE DERIVATIVES FOR ENHANCING BRAIN-DERIVED GROWTH FACTOR TO MITIGATE NEUROLOGICAL DISORDERS MARSHALL JOHN (US) 2022-07-14 — — WO 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-20240299566-A1 POLY-ARGININE DERIVATIVES FOR ENHANCING BRAIN-DERIVED GROWTH FACTOR TO MITIGATE NEUROLOGICAL DISORDERS PSD, BDNF, ARGLU1 C5AR1 3791/4885IL23R 2128/4885TACR1 2643/4885

“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.

Send feedback