SCHEMBL6948879

SCHEMBL6948879

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

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 7/20 0.42
NAALAD2 Q9Y3Q0 2/20 0.42
RIMKLA Q8IXN7 1/20 0.42
PLA2G2C Q5R387 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38
PTGS2 P35354 1/20 0.38
THPO P40225 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.37
FNTA P49354 2/20 0.37
FNTB P49356 2/20 0.37
GGH Q92820 1/20 0.37
GNPAT O15228 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
SCHEMBL6948884 1.00 FOLH1 (0.42) FOLH1NAALAD2RIMKLAPLA2G2CKDM4E
SCHEMBL12626915 0.88 FOLH1 (0.43) FOLH1NAALAD2RIMKLAGGH
SCHEMBL4363123 0.88 FOLH1 (0.43) FOLH1NAALAD2RIMKLAGGH
SCHEMBL3773280 0.87 CTSK (0.48) FOLH1NAALAD2RIMKLA
SCHEMBL863895 0.87 CTSK (0.48) FOLH1NAALAD2RIMKLA
SCHEMBL863894 0.87 CTSK (0.48) FOLH1NAALAD2RIMKLA
SCHEMBL21685691 0.85 FOLH1 (0.42) FOLH1NAALAD2RIMKLA
SCHEMBL21685690 0.85 FOLH1 (0.42) FOLH1NAALAD2RIMKLA
SCHEMBL29400405 0.85 FNTA (0.39) FOLH1KDM4EMAPTTHRBALOX15
SCHEMBL17715147 0.85 L3MBTL1 (0.41) KDM4EMAPTTHRBALOX15NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230141981-A1 NOVEL COMPOUNDS AND COMPOSITION FOR TARGETED THERAPY OF KIDNEY-ASSOCIATED CANCERS Shanghai MICURX Pharmaceuticals Co., Ltd. (CN) 2023-05-11 US disclosed
US-20230141981-A1 NOVEL COMPOUNDS AND COMPOSITION FOR TARGETED THERAPY OF KIDNEY-ASSOCIATED CANCERS Shanghai MICURX Pharmaceuticals Co., Ltd. (CN) 2023-05-11 US disclosed
WO-2019023295-A1 FATTY ACID MODIFIED HUMAN EPIDERMAL GROWTH FACTOR SAINT LOUIS UNIVERSITY (US) 2019-01-31 WO disclosed
US-20180029978-A1 PROCESS FOR MAKING LYSINE-GLUTAMIC ACID DIPEPTIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-02-01 US disclosed
US-9802886-B2 Process for making lysine-glutamic acid dipeptide derivatives HOFFMANN-LA ROCHE INC. (US) 2017-10-31 US disclosed
US-20170057912-A1 PROCESS FOR MAKING LYSINE-GLUTAMIC ACID DIPEPTIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2017-03-02 US disclosed
EP-0757677-B1 BENZOCYCLOHEXYLIMIDAZOLETHIONE DERIVATIVES SYNTEX LLC (US) 2003-06-18 EP disclosed
US-5719280-A REACTING AMINE SUBSTITUTED BENZOCYCLOALKANE WITH DIALKYLOXYACETALDEHYDE IN PRESENCE OF REDUCING AGENT OR CATALYTIC HYDROGENATION, TREATING WITH THIOCYANIC ACID SYNTEX (U.S.A.) INC. (US) 1998-02-17 US disclosed
EP-0757677-A1 BENZOCYCLOALKYLAZOLETHIONE DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1997-02-12 EP disclosed
US-5538988-A CARDIOVASCULAR DISORDERS AND DOPAMINE HYDROLASE ENZYME INHIBITORS SYNTEX (U.S.A.) INC. 1996-07-23 US disclosed
WO-1995029165-A2 BENZOCYCLOALKYLAZ0LETHIONE DERIVATIVES AS DOPAMIN BETA-HYDROXYLASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1995-11-02 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 (3 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-20230141981-A1 NOVEL COMPOUNDS AND COMPOSITION FOR TARGETED THERAPY OF KIDNEY-ASSOCIATED CANCERS GLS, ATP6V1B1, KRAS FOLH1 163/4885NAALAD2 3775/4885RIMKLA 4773/4885
US-20180029978-A1 PROCESS FOR MAKING LYSINE-GLUTAMIC ACID DIPEPTIDE DERIVATIVES GLUL, ASNS, QPCT FOLH1 52/4885NAALAD2 226/4885RIMKLA 39/4885
US-20170057912-A1 PROCESS FOR MAKING LYSINE-GLUTAMIC ACID DIPEPTIDE DERIVATIVES GLUL, ASNS, QPCT FOLH1 52/4885NAALAD2 226/4885RIMKLA 39/4885

“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.