SCHEMBL1711378

SCHEMBL1711378

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

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 1/20 0.48
FOLH1 Q04609 4/20 0.48
NPY4R P50391 9/20 0.43
NPY1R P25929 7/20 0.43
NPY2R P49146 5/20 0.43
NPY5R Q15761 4/20 0.43
C3AR1 Q16581 1/20 0.43
KISS1R Q969F8 2/20 0.42
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL1711946 1.00 NOD1 (0.48) NOD1FOLH1NPY4RNPY1RNPY2R
SCHEMBL30193452 0.92 NOD1 (0.52) NOD1FOLH1NPY4RNPY1RNPY2R
SCHEMBL3818717 0.92 NOD1 (0.54) NOD1FOLH1C3AR1
SCHEMBL2115693 0.92 NOD1 (0.54) NOD1FOLH1C3AR1
SCHEMBL29714936 0.91 FOLH1 (0.47) NOD1FOLH1NPY4RNPY1RNPY2R
SCHEMBL30400285 0.90 NPY4R (0.53) NOD1FOLH1NPY4RNPY1RNPY2R
SCHEMBL2107432 0.90 FOLH1 (0.46) NOD1FOLH1NPY4RNPY1RNPY2R
SCHEMBL1711082 0.90 FOLH1 (0.46) NOD1FOLH1NPY4RNPY1RNPY2R
SCHEMBL27736911 0.90 FOLH1 (0.46) NOD1FOLH1NPY4RNPY1RNPY2R
SCHEMBL30193523 0.87 FOLH1 (0.48) NOD1FOLH1NPY4RNPY1RNPY2R

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11052155-B2 Conjugates of CC-1065 analogs and bifunctional linkers SYNTARGA BV (NL) 2021-07-06 US disclosed
EP-3108886-B1 CONJUGATES OF CC-1065 ANALOGS AND BIFUNCTIONAL LINKERS SYNTARGA BV (NL) 2020-06-17 EP disclosed
EP-1909846-B1 TRIAZOLE-CONTAINING RELEASABLE LINKERS, CONJUGATES COMPRISING THE SAME AND PROCESSES FOR THEIR PREPARATION SYNTARGA BV (NL) 2018-12-26 EP disclosed
US-20180147289-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2018-05-31 US disclosed
US-20180133316-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2018-05-17 US disclosed
US-9901567-B2 Substituted CC-1065 analogs and their conjugates SYNTARGA B.V. (NL) 2018-02-27 US disclosed
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-11-23 US disclosed
US-9815784-B2 CC-1065 analogs and their conjugates SYNTARGA B.V. (NL) 2017-11-14 US disclosed
US-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-09-28 US disclosed
EP-2344478-B1 CC-1065 ANALOGS AND THEIR CONJUGATES SYNTARGA BV (NL) 2017-09-27 EP disclosed
US-20110065767-A1 Substituted CC-1065 Analogs and Their Conjugates SYNTARGA B.V. (NL) 2011-03-17 US disclosed
WO-2010062171-A2 NOVEL CC-1065 ANALOGS AND THEIR CONJUGATES SYNTARGA B.V. (NL) 2010-06-03 WO disclosed
EP-2173739-A1 SUBSTITUTED CC-1065 ANALOGS AND THEIR CONJUGATES Syntarga B.V. (NL) 2010-04-14 EP disclosed
US-20090318668-A1 Water-Soluble CC-1065 Analogs and Their Conjugates Georg-August-Universität Göttingen Stiftung öffentlichen Rechts (ohne Bereich Humanmedizin) (DE) 2009-12-24 US disclosed
WO-2009017394-A1 SUBSTITUTED CC-1065 ANALOGS AND THEIR CONJUGATES SYNTARGA B.V. (NL) 2009-02-05 WO disclosed
US-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation BYONDIS B.V. (NL) 2008-12-18 US disclosed
EP-1994000-A2 WATER-SOLUBLE CC-1065 ANALOGS AND THEIR CONJUGATES Syntarga B.V. (NL) 2008-11-26 EP disclosed
EP-1909846-A2 TRIAZOLE-CONTAINING RELEASABLE LINKERS, CONJUGATES THEREOF, AND METHODS OF PREPARATION Syntarga B.V. (NL) 2008-04-16 EP disclosed
WO-2007089149-A2 WATER-SOLUBLE CC-1065 ANALOGS AND THEIR CONJUGATES SYNTARGA B.V. (NL) 2007-08-09 WO disclosed
WO-2007018431-A2 TRIAZOLE-CONTAINING RELEASABLE LINKERS AND CONJUGATES COMPRISING THE SAME SYNTARGA B.V. (NL) 2007-02-15 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 (8 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-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L NOD1 3666/4885FOLH1 546/4885NPY4R 4799/4885
US-20090318668-A1 Water-Soluble CC-1065 Analogs and Their Conjugates PCNA, DCK, BAD NOD1 3209/4885FOLH1 1106/4885NPY4R 4879/4885
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L NOD1 3666/4885FOLH1 546/4885NPY4R 4799/4885
US-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation PAICS, CD44, TRIM33 NOD1 721/4885FOLH1 90/4885NPY4R 4278/4885
US-20180133316-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L NOD1 3666/4885FOLH1 546/4885NPY4R 4799/4885
US-11052155-B2 Conjugates of CC-1065 analogs and bifunctional linkers PCNA, DCLRE1A, CDC5L NOD1 3770/4885FOLH1 603/4885NPY4R 4742/4885
US-20110065767-A1 Substituted CC-1065 Analogs and Their Conjugates PCNA, TOP1, TOP2B NOD1 4345/4885FOLH1 899/4885NPY4R 4794/4885
US-20180147289-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L NOD1 3666/4885FOLH1 546/4885NPY4R 4799/4885

“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.