SCHEMBL30216222

SCHEMBL30216222

CC(C)[C@H](N)C(=O)N[C@@H](Cc1cn(C)c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 10/20 0.52
▸ CXCR4 P61073 1/20 0.50
▸ IL23R Q5VWK5 3/20 0.50
▸ CTSL P07711 2/20 0.50
▸ CTSS P25774 2/20 0.50
▸ CTSK P43235 2/20 0.50
▸ CTSH P09668 1/20 0.50
▸ KEAP1 Q14145 1/20 0.50
▸ GRPR P30550 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
SCHEMBL29871710 0.95 CTSL (0.53) GLP1RCXCR4IL23RCTSLCTSS
SCHEMBL29484313 0.93 NPBWR1 (0.55) GLP1RCXCR4IL23RCTSLCTSS
SCHEMBL30063985 0.91 GLP1R (0.54) GLP1RCXCR4IL23RCTSLCTSS
SCHEMBL29670477 0.91 NPBWR1 (0.56) GLP1RCXCR4CTSLCTSSCTSK
SCHEMBL30208638 0.91 GLP1R (0.57) GLP1RCXCR4IL23R
SCHEMBL30952344 0.89 GLP1R (0.61) GLP1R
SCHEMBL29484311 0.88 GLP1R (0.56) GLP1RIL23RCTSLCTSSCTSK
SCHEMBL29613390 0.88 IL23R (0.55) GLP1RIL23RCTSLCTSSCTSK
SCHEMBL29740501 0.88 GLP1R (0.59) GLP1RIL23R
SCHEMBL30338573 0.88 GLP1R (0.54) GLP1RCXCR4IL23RCTSLCTSS

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-20230075121-A1 CELL-PENETRATING COMPSTATIN ANALOGS AND USES THEREOF APELLIS PHARMACEUTICALS, INC. 2023-03-09 — — 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-20230075121-A1 CELL-PENETRATING COMPSTATIN ANALOGS AND USES THEREOF C9, C3AR1, SERPINC1 GLP1R 1092/4885CXCR4 1600/4885IL23R 2246/4885

“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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