SCHEMBL30823264

SCHEMBL30823264

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 1/20 0.50
▸ NPY4R P50391 11/20 0.44
▸ NPY1R P25929 6/20 0.44
▸ NPY2R P49146 4/20 0.44
▸ NPY5R Q15761 4/20 0.44
▸ GLP1R P43220 4/20 0.43
▸ SCTR P47872 1/20 0.43
▸ C5AR1 P21730 1/20 0.42
▸ PLK1 P53350 1/20 0.40
▸ KEAP1 Q14145 1/20 0.40

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
SCHEMBL29939588 0.93 C5AR1 (0.49) APLNRGLP1RSCTRC5AR1
SCHEMBL30680486 0.91 NPY4R (0.48) APLNRNPY4RNPY1RNPY2RNPY5R
SCHEMBL29965839 0.90 NPY4R (0.46) APLNRNPY4RNPY1RNPY2RNPY5R
SCHEMBL30645278 0.89 GLP1R (0.47) APLNRNPY4RNPY1RNPY2RNPY5R
SCHEMBL30645274 0.88 GLP1R (0.48) APLNRNPY4RNPY1RNPY2RNPY5R
SCHEMBL31683310 0.88 GLP1R (0.53) NPY4RNPY1RNPY2RNPY5RGLP1R
SCHEMBL6710584 0.87 NPY4R (0.51) APLNRNPY4RNPY1RNPY2RNPY5R
SCHEMBL6710592 0.87 NPY4R (0.51) APLNRNPY4RNPY1RNPY2RNPY5R
SCHEMBL30645275 0.87 GLP1R (0.44) APLNRNPY4RNPY1RNPY2RNPY5R
SCHEMBL31139071 0.87 APLNR (0.48) APLNRNPY4RNPY1RNPY2RNPY5R

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-20240066132-A1 NOVEL FATTY ACIDS AND THEIR USE IN CONJUGATION TO BIOMOLECULES NOVARTIS AG (CH) 2024-02-29 — — 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-20240066132-A1 NOVEL FATTY ACIDS AND THEIR USE IN CONJUGATION TO BIOMOLECULES FABP1, FABP2, FABP3 APLNR 37/4885NPY4R 922/4885NPY1R 717/4885

“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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