SCHEMBL26951919

SCHEMBL26951919

CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@@H](C(=O)NCC(=O)N[C@@H](CCCCNC(=O)[C@@H](N)CCCCN)C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccc(-c3ccccc3)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccc(-c3ccccc3)cc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]2CCCN2C1=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSG P08311 1/20 0.49
▸ ITGB3 P05106 1/20 0.48
▸ ITGB1 P05556 1/20 0.48
▸ ITGAV P06756 1/20 0.48
▸ ITGA5 P08648 1/20 0.48
▸ ITGB5 P18084 1/20 0.48
▸ EPHA2 P29317 3/20 0.48
▸ KEAP1 Q14145 1/20 0.48
▸ NFE2L2 Q16236 1/20 0.48
▸ KLKB1 P03952 5/20 0.47
▸ PIN1 Q13526 4/20 0.45
▸ KLK5 Q9Y337 1/20 0.44
▸ CD274 Q9NZQ7 1/20 0.44
▸ F12 P00748 2/20 0.44
▸ PLAU P00749 1/20 0.43

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
SCHEMBL26951904 0.96 CTSG (0.48) CTSGITGB3ITGB1ITGAVITGA5
SCHEMBL23743610 0.91 KLK5 (0.49) ITGB3ITGB1ITGAVITGA5ITGB5
SCHEMBL26951916 0.91 KEAP1 (0.48) CTSGITGB3ITGB1ITGAVITGA5
SCHEMBL26951743 0.88 KLKB1 (0.49) EPHA2KEAP1NFE2L2KLKB1PIN1
SCHEMBL23743537 0.88 KLKB1 (0.48) EPHA2KEAP1NFE2L2KLKB1PIN1
SCHEMBL26951558 0.88 KLKB1 (0.47) EPHA2KEAP1NFE2L2KLKB1PIN1
SCHEMBL26952055 0.87 KLKB1 (0.48) EPHA2KEAP1NFE2L2KLKB1KLK5
SCHEMBL26951937 0.86 KLKB1 (0.47) EPHA2KEAP1NFE2L2KLKB1PIN1
SCHEMBL26952071 0.86 KEAP1 (0.51) KEAP1NFE2L2KLKB1KLK5CD274
SCHEMBL23743518 0.85 KLKB1 (0.46) EPHA2KEAP1NFE2L2KLKB1PIN1

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-20230398224-A1 TARGETED PLASMA PROTEIN DEGRADATION NOVARTIS AG (CH) 2023-12-14 — — US disclosed
US-20230398224-A1 TARGETED PLASMA PROTEIN DEGRADATION NOVARTIS AG (CH) 2023-12-14 — — 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 (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-20230398224-A1 TARGETED PLASMA PROTEIN DEGRADATION M6PR, ASGR1, IGF2R CTSG 379/4885ITGB3 2014/4885ITGB1 1194/4885

“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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