SCHEMBL30175378

SCHEMBL30175378

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 8/20 0.56
▸ CALCR P30988 8/20 0.56
▸ CXCR4 P61073 2/20 0.54
▸ NPY2R P49146 7/20 0.53
▸ NPY4R P50391 7/20 0.53
▸ NPY5R Q15761 7/20 0.53
▸ NPY1R P25929 5/20 0.53
▸ KEAP1 Q14145 1/20 0.52
▸ MAPK8 P45983 1/20 0.52
▸ MAPK9 P45984 1/20 0.52
▸ MAPK10 P53779 1/20 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
SCHEMBL30085017 0.92 CXCR4 (0.60) CXCR4NPY2RNPY4RNPY5RNPY1R
SCHEMBL29616793 0.89 RAMP3 (0.49) RAMP3CALCRCXCR4
SCHEMBL31474426 0.89 RAMP3 (0.61) RAMP3CALCRCXCR4NPY2RNPY4R
SCHEMBL29375786 0.89 NPY2R (0.58) RAMP3CALCRCXCR4NPY2RNPY4R
SCHEMBL31437159 0.89 CXCR4 (0.54) CXCR4NPY2RNPY4RNPY5RNPY1R
Qatvgdvntdrpglldlk SCHEMBL30399126 0.88 NPY2R (0.60) RAMP3CALCRCXCR4NPY2RNPY4R
SCHEMBL30974402 0.88 NPY2R (0.55) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30906350 0.88 NPY2R (0.59) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29380215 0.88 RAMP3 (0.53) RAMP3CALCRCXCR4NPY2RNPY4R
SCHEMBL30930178 0.88 CALCR (0.53) RAMP3CALCRCXCR4NPY2RNPY4R

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-20230076768-A1 IL2 Orthologs and Methods of Use SYNTHEKINE, 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-20230076768-A1 IL2 Orthologs and Methods of Use IL2RA, IL23R, IL2 RAMP3 1517/4885CALCR 1207/4885CXCR4 401/4885

“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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