SCHEMBL30821694

SCHEMBL30821694

C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.69
▸ CTSS P25774 3/20 0.69
▸ CTSK P43235 3/20 0.69
▸ CTSH P09668 1/20 0.67
▸ C5AR1 P21730 2/20 0.64
▸ CXCR4 P61073 6/20 0.59
▸ GLP1R P43220 4/20 0.55
▸ GCGR P47871 4/20 0.55
▸ GIPR P48546 1/20 0.55
▸ NMBR P28336 2/20 0.55
▸ GRPR P30550 2/20 0.55
▸ KEAP1 Q14145 1/20 0.55

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
SCHEMBL29677323 0.94 CTSL (0.67) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL29387696 0.94 CTSL (0.64) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL29513768 0.92 CTSL (0.62) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL32659744 0.89 C5AR1 (0.67) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL30600019 0.89 C5AR1 (0.67) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL29793911 0.89 C5AR1 (0.64) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL30574265 0.88 C5AR1 (0.56) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL29390561 0.87 C5AR1 (0.67) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL31757090 0.87 C5AR1 (0.67) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL31150419 0.87 CTSL (0.63) CTSLCTSSCTSKCTSHC5AR1

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
EP-4587450-A1 MODIFIED CHOLIC ACID CONJUGATES Ultra, LLC (US) 2025-07-23 — — EP disclosed
CN-120202209-A Modified cholic acid conjugate 乌尔特拉有限责任公司 2025-06-24 — — CN disclosed
US-20240335547-A1 MODIFIED CHOLIC ACID CONJUGATES ULTRA, LLC (US) 2024-10-10 — — US disclosed
WO-2024058975-A1 MODIFIED CHOLIC ACID CONJUGATES ULTRA, LLC (US) 2024-03-21 — — WO 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-20240335547-A1 MODIFIED CHOLIC ACID CONJUGATES MMAB, NR1H4, CHKB CTSL 2927/4885CTSS 2407/4885CTSK 1971/4885

“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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