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Sugi Predict / Compounds / SCHEMBL30168689

SCHEMBL30168689

SCHEMBL30168689

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.57
▸ IL23R Q5VWK5 9/20 0.56
▸ VIPR2 P41587 5/20 0.56
▸ F2 P00734 2/20 0.55
▸ VIPR1 P32241 4/20 0.54

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
SCHEMBL29836412 0.97 TFPI (0.57) TFPIIL23RVIPR2F2VIPR1
SCHEMBL30168722 0.96 TFPI (0.59) TFPIIL23RVIPR2F2VIPR1
SCHEMBL30168723 0.95 TFPI (0.62) TFPIIL23RVIPR2F2VIPR1
SCHEMBL30168765 0.95 TFPI (0.63) TFPIIL23RVIPR2F2VIPR1
SCHEMBL30168754 0.94 IL23R (0.58) TFPIIL23RF2
SCHEMBL29836399 0.93 TFPI (0.59) TFPIIL23RVIPR2F2VIPR1
SCHEMBL29836540 0.92 TFPI (0.63) TFPIIL23RVIPR2F2VIPR1
SCHEMBL30648453 0.92 TFPI (0.61) TFPIIL23RVIPR2VIPR1
SCHEMBL29836514 0.92 TFPI (0.64) TFPIIL23RF2VIPR1
SCHEMBL29836414 0.91 IL23R (0.58) TFPIIL23RF2

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-12428638-B2 Three-component CRISPR/Cas complex system and uses thereof THE JACKSON LABORATORY (US) 2025-09-30 — — US disclosed
US-20230071712-A1 THREE-COMPONENT CRISPR/CAS COMPLEX SYSTEM AND USES THEREOF THE JACKSON LABORATORY (US) 2023-03-09 — — US disclosed
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