SCHEMBL32677743

SCHEMBL32677743

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 7/20 0.52
▸ GNRHR P30968 1/20 0.52
▸ CAPN1 P07384 2/20 0.51
▸ CTSB P07858 2/20 0.51
▸ KISS1R Q969F8 2/20 0.50
▸ CXCL8 P10145 5/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ NPBWR1 P48145 1/20 0.50

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
SCHEMBL31058451 0.96 CXCR4 (0.52) CXCR4CAPN1CTSBKISS1RCXCL8
SCHEMBL30523243 0.93 CXCR4 (0.54) CXCR4GNRHRCAPN1CTSBKISS1R
SCHEMBL32677767 0.91 CAPN1 (0.58) CXCR4CAPN1CTSB
SCHEMBL32677770 0.91 CAPN1 (0.58) CXCR4CAPN1CTSB
SCHEMBL30467090 0.90 CAPN1 (0.52) CXCR4GNRHRCAPN1CTSBCXCL8
SCHEMBL31058453 0.89 GLP1R (0.55) —
SCHEMBL31241397 0.89 DPP3 (0.51) CXCR4CAPN1CTSBCXCL8
SCHEMBL31058456 0.88 C5AR1 (0.56) —
SCHEMBL29616500 0.87 CXCR4 (0.61) CXCR4
SCHEMBL30608594 0.86 CAPN1 (0.54) CXCR4CAPN1CTSB

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-20260055154-A1 LONG-ACTING DUAL-AGONIST COMPOUND CHENGDU AODA BIOTECHNOLOGY CO LTD (CN) 2026-02-26 — — 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-20260055154-A1 LONG-ACTING DUAL-AGONIST COMPOUND GIPR, GLP1R, GCG CXCR4 2521/4885GNRHR 381/4885CAPN1 2622/4885

“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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