SCHEMBL17581833

SCHEMBL17581833

CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](CCCNC(N)=O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 3/20 0.52
▸ CTSK P43235 3/20 0.52
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ CA2 P00918 1/20 0.43
▸ CAPN1 P07384 1/20 0.42
▸ C3AR1 Q16581 1/20 0.42
▸ ATM Q13315 1/20 0.41
▸ BACE1 P56817 3/20 0.41

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
SCHEMBL17902991 1.00 CTSS (0.52) CTSSCTSKMEN1KMT2AGAA
SCHEMBL12283739 1.00 CTSS (0.52) CTSSCTSKMEN1KMT2AGAA
SCHEMBL13436631 1.00 CTSS (0.52) CTSSCTSKMEN1KMT2AGAA
SCHEMBL14012280 1.00 CTSS (0.52) CTSSCTSKMEN1KMT2AGAA
SCHEMBL23998665 0.97 CTSS (0.51) CTSSCTSKMEN1KMT2AGAA
SCHEMBL23106074 0.92 CTSK (0.50) CTSSCTSKMEN1KMT2AGAA
SCHEMBL29593613 0.91 CTSK (0.53) CTSSCTSKMEN1KMT2AGAA
SCHEMBL25459969 0.90 CTSK (0.48) CTSSCTSKMEN1KMT2AGAA
SCHEMBL17209941 0.90 CTSK (0.48) CTSSCTSKMEN1KMT2AGAA
SCHEMBL28342732 0.90 CTSK (0.48) CTSSCTSKMEN1KMT2AGAA

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12152083-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same ZYMEWORKS BC INC. 2024-11-26 — — US disclosed
US-20230317700-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2023-10-05 — — US disclosed
US-11591405-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same ZYMEWORKS BC INC. 2023-02-28 — — US disclosed
EP-4029873-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME Zymeworks Inc. (CA) 2022-07-20 — — EP disclosed
EP-3194421-B1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS INC (CA) 2021-11-03 — — EP disclosed
CN-113416229-A Cytotoxic and antimitotic compounds, and methods of use thereof 酵活有限公司 2021-09-21 — — CN disclosed
CN-107001415-B Cytotoxic and antimitotic compounds, and methods of use thereof 酵活有限公司 2021-06-18 — — CN disclosed
US-20200207865-A2 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2020-07-02 — — US disclosed
US-20190345254-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS INC (CA) 2019-11-14 — — US disclosed
US-10450378-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same ZYMEWORKS INC. (CA) 2019-10-22 — — US disclosed
US-10414822-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same ZYMEWORKS INC. (CA) 2019-09-17 — — US disclosed
US-20180208667-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2018-07-26 — — US disclosed
US-9879086-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same ZYMEWORKS INC. (CA) 2018-01-30 — — US disclosed
US-20170247408-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2017-08-31 — — US disclosed
EP-3194421-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME Zymeworks, Inc. (CA) 2017-07-26 — — EP disclosed
WO-2016041082-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME CDRD Ventures, Inc. (CA) 2016-03-24 — — WO disclosed
US-20160075735-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2016-03-17 — — 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 (9 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-20160075735-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-20190345254-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-20170247408-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-20200207865-A2 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-11591405-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-12152083-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-10414822-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-10450378-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885
US-20180208667-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME CCNB1, PLK1, BOD1L1 CTSS 834/4885CTSK 1063/4885MEN1 959/4885

“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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