SCHEMBL29707524

SCHEMBL29707524

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)O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.56
▸ IL23R Q5VWK5 1/20 0.55
▸ CAPN1 P07384 2/20 0.53
▸ CTSB P07858 2/20 0.53
▸ TACR1 P25103 1/20 0.53
▸ CXCL8 P10145 5/20 0.53
▸ CXCR4 P61073 3/20 0.52
▸ DPP3 Q9NY33 2/20 0.52
▸ GLP1R P43220 4/20 0.52
▸ GIPR P48546 4/20 0.52

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
SCHEMBL29707519 0.99 C5AR1 (0.56) C5AR1IL23RCAPN1CTSBTACR1
SCHEMBL29707518 0.96 C5AR1 (0.61) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL31119411 0.96 C5AR1 (0.61) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL29707517 0.93 C5AR1 (0.61) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL29707516 0.93 C5AR1 (0.61) C5AR1IL23RTACR1CXCR4GLP1R
SCHEMBL31357810 0.85 DPP3 (0.57) IL23RCAPN1CTSBTACR1DPP3
SCHEMBL29706251 0.85 CXCR4 (0.58) IL23RCAPN1CTSBCXCR4GLP1R
SCHEMBL30168658 0.85 GLP1R (0.61) CXCL8GLP1RGIPR
SCHEMBL30567724 0.84 CXCL8 (0.58) C5AR1IL23RCXCL8CXCR4
SCHEMBL30608621 0.84 CAPN1 (0.50) C5AR1CAPN1CTSBCXCL8CXCR4

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 2128/4885CAPN1 2543/4885

“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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