SCHEMBL29579701

SCHEMBL29579701

CC(C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP3 Q9NY33 5/20 0.56
▸ CALCRL Q16602 5/20 0.56
▸ RAMP1 O60894 1/20 0.56
▸ C5AR1 P21730 2/20 0.49
▸ SLC6A2 P23975 1/20 0.49
▸ TACR1 P25103 1/20 0.48
▸ NTSR2 O95665 1/20 0.47
▸ NTSR1 P30989 1/20 0.47
▸ SORT1 Q99523 1/20 0.47
▸ REN P00797 1/20 0.47
▸ CCKBR P32239 1/20 0.47

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
SCHEMBL31058453 0.88 GLP1R (0.55) C5AR1
SCHEMBL29579489 0.88 CALCRL (0.64) CALCRLRAMP1SLC6A2REN
SCHEMBL29579716 0.88 CALCRL (0.61) CALCRLRAMP1SLC6A2REN
SCHEMBL31058456 0.87 C5AR1 (0.56) C5AR1
SCHEMBL29580098 0.87 SLC6A2 (0.64) CALCRLRAMP1SLC6A2REN
SCHEMBL29579706 0.87 CALCRL (0.60) CALCRLRAMP1SLC6A2REN
SCHEMBL29579417 0.86 CALCRL (0.62) CALCRLRAMP1SLC6A2
SCHEMBL29580071 0.86 CALCRL (0.61) CALCRLRAMP1SLC6A2REN
SCHEMBL29579122 0.86 CALCRL (0.59) DPP3CALCRLRAMP1SLC6A2REN
SCHEMBL31241397 0.86 DPP3 (0.51) DPP3NTSR2NTSR1SORT1CCKBR

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-12043674-B2 Synthetic cyclic peptides and methods of preparation and use thereof AUBURN UNIVERSITY (US) 2024-07-23 — — US disclosed
US-20220119445-A1 SYNTHETIC CYCLIC PEPTIDES AND METHODS OF PREPARATION AND USE THEREOF NATIONAL SCIENCE FOUNDATION 2022-04-21 — — 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 (2 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-12043674-B2 Synthetic cyclic peptides and methods of preparation and use thereof VIP, PTMS, IAPP DPP3 489/4885CALCRL 78/4885RAMP1 1411/4885
US-20220119445-A1 SYNTHETIC CYCLIC PEPTIDES AND METHODS OF PREPARATION AND USE THEREOF VIP, PTMS, IAPP DPP3 489/4885CALCRL 78/4885RAMP1 1411/4885

“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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