SCHEMBL22688083

SCHEMBL22688083

COCCOCCOCCOCCOCCOCCOCCOCCC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 1/20 0.42
▸ ACE P12821 1/20 0.41
▸ CTSS P25774 7/20 0.40
▸ CTSK P43235 7/20 0.40
▸ PPARA Q07869 6/20 0.40
▸ CTSL P07711 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ PPARG P37231 5/20 0.38
▸ SUCNR1 Q9BXA5 1/20 0.38
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 1/20 0.37
▸ PPARD Q03181 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ EGLN2 Q96KS0 1/20 0.36

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
SCHEMBL28694914 1.00 CAPN1 (0.42) CAPN1ACECTSSCTSKPPARA
SCHEMBL21713192 0.85 CAPN1 (0.46) CAPN1CTSSCTSKITGB3ITGA2B
SCHEMBL27145930 0.85 CAPN1 (0.46) CAPN1CTSSCTSKITGB3ITGA2B
SCHEMBL21713193 0.85 CAPN1 (0.46) CAPN1CTSSCTSKITGB3ITGA2B
SCHEMBL27145928 0.85 CAPN1 (0.46) CAPN1CTSSCTSKITGB3ITGA2B
SCHEMBL31045346 0.85 CAPN1 (0.46) CAPN1CTSSCTSKITGB3ITGA2B
SCHEMBL27150954 0.85 CAPN1 (0.46) CAPN1CTSSCTSKITGB3ITGA2B
SCHEMBL27333243 0.83 SUCNR1 (0.36) CAPN1CTSSCTSKCTSLCTSB
SCHEMBL1278066 0.81 PPARA (0.53) ACECTSSCTSKPPARACTSL
SCHEMBL22688030 0.80 HPGD (0.36) CAPN1ACECTSSCTSKCTSL

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-20220409734-A1 ANTIBODY DRUG CONJUGATES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-12-29 — — US disclosed
EP-3965891-A1 ANTIBODY DRUG CONJUGATES Takeda Pharmaceutical Company Limited (JP) 2022-03-16 — — EP disclosed
CN-114173824-A Antibody drug conjugates 武田药品工业株式会社 2022-03-11 — — CN disclosed
WO-2020229982-A1 ANTIBODY DRUG CONJUGATES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-11-19 — — 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-20220409734-A1 ANTIBODY DRUG CONJUGATES STING1, CGAS, TBK1 CAPN1 3770/4885ACE 4384/4885CTSS 3459/4885

“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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