SCHEMBL30259624

SCHEMBL30259624

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 6/20 0.58
▸ ERAP1 Q9NZ08 4/20 0.55
▸ IL1RN P18510 4/20 0.55
▸ ECE1 P42892 5/20 0.54
▸ ANPEP P15144 1/20 0.52
▸ GHSR Q92847 6/20 0.52
▸ ACE P12821 1/20 0.50

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
SCHEMBL30590781 0.96 ERAP2 (0.56) ERAP2ERAP1IL1RNECE1ANPEP
SCHEMBL30590798 0.96 ERAP2 (0.56) ERAP2ERAP1IL1RNECE1ANPEP
SCHEMBL29427859 0.93 ERAP2 (0.63) ERAP2ERAP1IL1RNECE1ANPEP
SCHEMBL31615095 0.92 GHSR (0.58) GHSR
SCHEMBL30590790 0.91 ECE1 (0.53) ERAP2ERAP1IL1RNECE1GHSR
SCHEMBL31473234 0.91 NPBWR1 (0.53) ERAP2GHSR
SCHEMBL31473233 0.91 NPBWR1 (0.53) ERAP2GHSR
SCHEMBL29663506 0.91 GHSR (0.52) ERAP2ERAP1IL1RNECE1ANPEP
SCHEMBL29516260 0.90 ERAP2 (0.61) ERAP2ERAP1IL1RNECE1ANPEP
SCHEMBL30500405 0.90 ECE1 (0.59) ERAP2ERAP1IL1RNECE1ANPEP

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
US-12590325-B2 Directed evolution for obtaining improved variants of TEV protease for biotechnological applications CZ BIOHUB SF, LLC (US) 2026-03-31 — — US disclosed
US-20260074011-A1 END-TO-END MACHINE LEARNING-DRIVEN DESIGN OF PROTEINS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2026-03-12 — — US disclosed
WO-2024044362-A1 END-TO-END MACHINE LEARNING-DRIVEN DESIGN OF PROTEINS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2024-02-29 — — WO disclosed
US-20230067225-A1 IMPROVED VARIANTS OF TEV PROTEASE FOR BIOTECHNOLOGICAL APPLICATIONS CHAN ZUCKERBERG BIOHUB, INC. 2023-03-02 — — 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-12590325-B2 Directed evolution for obtaining improved variants of TEV protease for biotechnological applications CRY2, CRY1, CRYZ ERAP2 190/4885ERAP1 105/4885IL1RN 4369/4885
US-20260074011-A1 END-TO-END MACHINE LEARNING-DRIVEN DESIGN OF PROTEINS SET, MAX, FCGR3B ERAP2 1475/4885ERAP1 353/4885IL1RN 827/4885

“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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