SCHEMBL17650869

SCHEMBL17650869

[CH2]c1ccc(NC(=O)[C@H](CCCCN)NC(=O)C2(C(=O)NCCCCCN3C(=O)C=CC3=O)CCC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PLG P00747 1/20 0.36
▸ KLKB1 P03952 1/20 0.34
▸ PDF Q9HBH1 1/20 0.34
▸ HDAC3 O15379 5/20 0.34
▸ HDAC1 Q13547 5/20 0.34
▸ HDAC2 Q92769 5/20 0.34
▸ HDAC10 Q969S8 5/20 0.34
▸ HDAC11 Q96DB2 5/20 0.34
▸ HDAC8 Q9BY41 5/20 0.34
▸ HDAC6 Q9UBN7 5/20 0.34
▸ SIRT1 Q96EB6 4/20 0.33
▸ EHMT2 Q96KQ7 1/20 0.33
▸ ROCK2 O75116 1/20 0.33
▸ NMT2 O60551 5/20 0.33
▸ NMT1 P30419 5/20 0.33
▸ SIRT6 Q8N6T7 1/20 0.33
▸ NCOR2 Q9Y618 2/20 0.33
▸ SIRT2 Q8IXJ6 3/20 0.32

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
SCHEMBL18332122 0.92 PLG (0.38) PLGKLKB1PDFHDAC3HDAC1
SCHEMBL17650868 0.92 HDAC3 (0.32) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL22698653 0.91 SIRT2 (0.36) PLGKLKB1SIRT1SIRT2
SCHEMBL25413079 0.90 HDAC3 (0.36) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20831162 0.89 SIRT2 (0.36) PLGKLKB1SIRT1SIRT2
SCHEMBL17651521 0.88 CA1 (0.41) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL21695294 0.84 HDAC3 (0.37) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL16847844 0.84 OPRM1 (0.33) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL17801960 0.84 ITGB1 (0.34) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL17813693 0.83 RAB9A (0.36) SIRT1SIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230041134-A1 Anti-HER2 Antibodies and Immunoconjugates GENENTECH, INC. (US) 2023-02-09 — — US disclosed
EP-3782654-A1 ANTI-HER2 ANTIBODIES AND IMMUNOCONJUGATES Genentech, Inc. (US) 2021-02-24 — — EP disclosed
EP-3191135-B1 ANTI-HER2 ANTIBODIES AND IMMUNOCONJUGATES GENENTECH INC (US) 2020-08-19 — — EP disclosed
US-20200255539-A1 Anti-HER2 Antibodies and Immunoconjugates GENENTECH, INC. 2020-08-13 — — US disclosed
US-10556966-B2 Anti-HER2 antibodies and immunoconjugates GENENTECH, INC. 2020-02-11 — — US disclosed
US-20190177429-A1 Anti-HER2 Antibodies and Immunoconjugates GENENTECH, INC. (US) 2019-06-13 — — US disclosed
US-10179820-B2 Anti-HER2 antibodies and immunoconjugates GENENTECH, INC. (US) 2019-01-15 — — US disclosed
US-10124069-B2 Peptidomimetic compounds and antibody-drug conjugates thereof GENENTECH, INC. (US) 2018-11-13 — — US disclosed
US-20170174782-A1 ANTI-HER2 ANTIBODIES AND IMMUNOCONJUGATES GENENTECH, INC. (US) 2017-06-22 — — US disclosed
US-9518118-B2 Anti-HER2 antibodies and immunoconjugates GENENTECH, INC. (US) 2016-12-13 — — US disclosed
US-20160279261-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2016-09-29 — — US disclosed
US-20160096893-A1 ANTI-HER2 ANTIBODIES AND IMMUNOCONJUGATES GENENTECH, INC. (US) 2016-04-07 — — 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-10179820-B2 Anti-HER2 antibodies and immunoconjugates ERBB2, EGFR, ERBB3 PLG 3612/4885KLKB1 921/4885PDF 4083/4885
US-20190177429-A1 Anti-HER2 Antibodies and Immunoconjugates ERBB2, EGFR, ERBB3 PLG 3612/4885KLKB1 921/4885PDF 4083/4885
US-10556966-B2 Anti-HER2 antibodies and immunoconjugates ERBB2, EGFR, ERBB3 PLG 3612/4885KLKB1 921/4885PDF 4083/4885
US-20160096893-A1 ANTI-HER2 ANTIBODIES AND IMMUNOCONJUGATES ERBB2, EGFR, ERBB3 PLG 3612/4885KLKB1 921/4885PDF 4083/4885
US-20200255539-A1 Anti-HER2 Antibodies and Immunoconjugates ERBB2, EGFR, ERBB3 PLG 3612/4885KLKB1 921/4885PDF 4083/4885
US-20170174782-A1 ANTI-HER2 ANTIBODIES AND IMMUNOCONJUGATES ERBB2, EGFR, ERBB3 PLG 3612/4885KLKB1 921/4885PDF 4083/4885
US-20230041134-A1 Anti-HER2 Antibodies and Immunoconjugates ERBB2, EGFR, ERBB3 PLG 3612/4885KLKB1 921/4885PDF 4083/4885
US-20160279261-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF DNPEP, LNPEP, BCR PLG 381/4885KLKB1 845/4885PDF 259/4885
US-10124069-B2 Peptidomimetic compounds and antibody-drug conjugates thereof DNPEP, LNPEP, BCR PLG 381/4885KLKB1 845/4885PDF 259/4885

“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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