SCHEMBL626315

SCHEMBL626315

CN(C(=O)OC(C)(C)C)C(CO)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.39
MMP13 P45452 1/20 0.39
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
HDAC6 Q9UBN7 2/20 0.33
CA14 Q9ULX7 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
ASGR1 P07306 1/20 0.31
REN P00797 1/20 0.30

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
SCHEMBL626316 1.00 AAK1 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL16972355 1.00 AAK1 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL9447853 0.86 MMP13 (0.38) AAK1MMP13MEN1GAAKMT2A
SCHEMBL27908634 0.85 MMP13 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL7401175 0.85 MMP13 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL1162878 0.85 MMP13 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL1273585 0.85 MMP13 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL953166 0.85 MMP13 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL7401177 0.85 MMP13 (0.39) AAK1MMP13MEN1GAAKMT2A
SCHEMBL2480210 0.85 MMP13 (0.36) AAK1MMP13MEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-07-29 US disclosed
US-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-12-05 US disclosed
CN-118324664-A Serine derivative preparation method 四川鸿日医药科技有限公司 2024-07-12 CN disclosed
CN-109563126-B Proteasome inhibitors 马克斯-普朗克科学促进学会 2023-06-16 CN disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 US disclosed
EP-3464321-B1 PROTEASOME INHIBITORS MAX PLANCK GESELLSCHAFT (DE) 2023-01-25 EP disclosed
CN-111333528-B Synthesis method of multi-configuration O-phenyl-serine compound 苏州爱玛特生物科技有限公司 2022-10-21 CN disclosed
EP-4043478-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITING ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-08-17 EP disclosed
US-11345724-B2 Proteasome inhibitors MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-05-31 US disclosed
US-20200325171-A1 PROTEASOME INHIBITORS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2020-10-15 US disclosed
US-20120252778-A1 PYRAZOLO PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2012-10-04 US disclosed
CN-102639513-A Sphingosine kinase inhibitors MERCK PATENT GMBH 2012-08-15 CN disclosed
WO-2012021796-A2 NOVEL CYCLOSPORIN DERIVATIVES FOR THE TREATMENT AND PREVENTION OF A VIRAL INFECTION S&T GLOBAL, INC. (US) 2012-02-16 WO disclosed
US-20110275673-A1 INHIBITORS OF SPHINGOSINE KINASE 1 GENZYME CORPORATION 2011-11-10 US disclosed
WO-2011082732-A1 SPHINGOSINE KINASE INHIBITORS MERCK PATENT GMBH (DE) 2011-07-14 WO disclosed
US-20110034469-A1 Heterocyclic Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-02-10 US disclosed
US-20100093704-A1 NOVEL PSYCHOTROPIC AGENTS HAVING GLUTAMATE NMDA ACTIVITY RAMOT AT TEL-AVIV UNIVERSITY LTD (IL) 2010-04-15 US disclosed
WO-2010033701-A2 INHIBITORS OF SPHINGOSINE KINASE 1 GENZYME CORPORATION (US) 2010-03-25 WO disclosed
US-6180611-B1 INHIBITORS OF MATRIX METALLOPROTEINASES AND TUMOR NECROSIS FACTOR DARWIN DISCOVERY, LTD. (GB) 2001-01-30 US disclosed
US-5994312-A Peptidyl compounds DARWIN DISCOVERY, LTD. (GB) 1999-11-30 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-20110034469-A1 Heterocyclic Compound BIRC5, XIAP, BIRC2 AAK1 2940/4885MMP13 4138/4885MEN1 363/4885
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS AAK1 928/4885MMP13 3770/4885MEN1 492/4885
US-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS AAK1 928/4885MMP13 3770/4885MEN1 492/4885
US-20200325171-A1 PROTEASOME INHIBITORS PSMB1, PSMB2, PSMB5 AAK1 3401/4885MMP13 3814/4885MEN1 2770/4885
US-20110275673-A1 INHIBITORS OF SPHINGOSINE KINASE 1 SPHK1, SPHK2, S1PR1 AAK1 72/4885MMP13 1916/4885MEN1 2381/4885
US-20120252778-A1 PYRAZOLO PYRIMIDINE DERIVATIVES THPO, P2RX3, P2RX5 AAK1 1200/4885MMP13 3473/4885MEN1 4318/4885
US-20100093704-A1 NOVEL PSYCHOTROPIC AGENTS HAVING GLUTAMATE NMDA ACTIVITY GRIN1, GRIN2A, GRIN2B AAK1 696/4885MMP13 4627/4885MEN1 3397/4885
US-11345724-B2 Proteasome inhibitors PSMB1, PSMB2, PSMB5 AAK1 3289/4885MMP13 3616/4885MEN1 3000/4885
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action KRAS, NRAS, HRAS AAK1 928/4885MMP13 3770/4885MEN1 492/4885

“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.