Sugi Predict

Sugi Predict / Compounds / SCHEMBL30305967

SCHEMBL30305967

SCHEMBL30305967

CC[C@H](C)[C@H](NC(=O)[C@@H](NC[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1cnc[nH]1)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.92

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 16/20 0.92
▸ AGTR1 P30556 1/20 0.63
▸ AGTR2 P50052 1/20 0.63
▸ LNPEP Q9UIQ6 2/20 0.62

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
SCHEMBL24849923 0.86 REN (0.78) RENAGTR1AGTR2LNPEP
Angiotensin Iv SCHEMBL10066237 0.83 LNPEP (0.82) RENAGTR1AGTR2LNPEP
Angiotensin Iv SCHEMBL27169570 0.83 LNPEP (0.82) RENAGTR1AGTR2LNPEP
SCHEMBL29394906 0.83 REN (0.79) RENAGTR1AGTR2LNPEP
SCHEMBL29619763 0.82 AGTR1 (0.75) RENAGTR1AGTR2LNPEP
SCHEMBL29448209 0.80 REN (0.66) RENAGTR1AGTR2LNPEP
SCHEMBL13234128 0.80 AGTR1 (0.69) RENAGTR1AGTR2LNPEP
SCHEMBL31332289 0.80 AGTR2 (0.91) RENAGTR1AGTR2LNPEP
Angiotensin Ii SCHEMBL1189 0.79 AGTR2 (0.84) RENAGTR1AGTR2LNPEP
Angiotensin Ii SCHEMBL2566771 0.79 AGTR2 (0.84) RENAGTR1AGTR2LNPEP

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116298309-B High throughput cloning of paired bipartite immunoreceptor polynucleotides and uses thereof 根路径基因组学公司 2024-04-02 — — CN disclosed
CN-116298309-A High throughput cloning of paired bipartite immunoreceptor polynucleotides and uses thereof 根路径基因组学公司 2023-06-23 — — CN disclosed
CN-116144706-A High throughput cloning of paired bipartite immunoreceptor polynucleotides and uses thereof 根路径基因组学公司 2023-05-23 — — CN disclosed
CN-112840031-B High throughput cloning and use of paired bipartite immunoreceptor polynucleotides 根路径基因组学公司 2023-03-24 — — CN disclosed
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