SCHEMBL30880872

SCHEMBL30880872

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.60
▸ APLNR P35414 2/20 0.59
▸ CALCR P30988 4/20 0.58
▸ IL23R Q5VWK5 1/20 0.57
▸ NPY2R P49146 7/20 0.56
▸ NPY4R P50391 7/20 0.56
▸ NPY5R Q15761 7/20 0.56
▸ NPY1R P25929 5/20 0.56
▸ MC4R P32245 1/20 0.54
▸ F2 P00734 1/20 0.53

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
SCHEMBL29761728 0.90 CALCR (0.61) C5AR1APLNRCALCRNPY2RNPY4R
SCHEMBL29377908 0.88 C5AR1 (0.63) C5AR1APLNRCALCRNPY2RNPY4R
SCHEMBL31745639 0.87 CALCR (0.56) C5AR1APLNRCALCRNPY2RNPY4R
SCHEMBL29569062 0.87 C5AR1 (0.65) C5AR1APLNR
SCHEMBL34469957 0.86 AGTR1 (0.62) C5AR1APLNRF2
SCHEMBL29569348 0.86 NTSR1 (0.59) C5AR1CALCRF2
SCHEMBL29569693 0.86 AGTR1 (0.62) C5AR1APLNRCALCRMC4RF2
SCHEMBL29976758 0.86 AGTR2 (0.65) C5AR1APLNRF2
SCHEMBL29551839 0.85 APLNR (0.55) C5AR1APLNRMC4R
SCHEMBL29973760 0.85 AGTR2 (0.63) C5AR1APLNRF2

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-12570729-B2 Antibody fragment based antifungal conjugate selectively targeting candida ABGENICS LIFESCIENCES PRIVATE LIMITED (IN) 2026-03-10 — — US disclosed
US-20240092878-A1 AN ANTIBODY FRAGMENT BASED ANTIFUNGAL CONJUGATE SELECTIVELY TARGETING CANDIDA ABGENICS LIFESCIENCES PRIVATE LIMITED (IN) 2024-03-21 — — 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-12570729-B2 Antibody fragment based antifungal conjugate selectively targeting candida SERPINH1, HM13, NGLY1 C5AR1 1093/4885APLNR 1340/4885CALCR 3315/4885

“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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