SCHEMBL2507441

SCHEMBL2507441

CN(C)CCNCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KDM4A O75164 11/20 0.41
KDM4C Q9H3R0 11/20 0.41
ANPEP P15144 1/20 0.41
KDM5A P29375 1/20 0.41
KDM7A Q6ZMT4 1/20 0.41
PHF8 Q9UPP1 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
PRMT3 O60678 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT1 Q99873 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PAOX Q6QHF9 1/20 0.38

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
SCHEMBL31370514 0.86 PAOX (0.53) KDM4AKDM4CKDM5AKDM7APHF8
SCHEMBL29256117 0.84 CYP2C9 (0.48) CYP2C9CYP2C19KDM4AKDM4CANPEP
SCHEMBL27293107 0.81 PAOX (0.47) CYP2C9CYP2C19ANPEPPRMT3CARM1
SCHEMBL16158922 0.80 MVD (0.42) CYP2C19KDM4CKDM5AKDM7APHF8
SCHEMBL31370382 0.80 CTH (0.34) KDM4AKDM4CKDM5AKDM7APHF8
SCHEMBL27293082 0.79 CYP2C9 (0.43) CYP2C9CYP2C19ANPEPPRMT3CARM1
SCHEMBL28709277 0.79 CYP2C9 (0.48) CYP2C9CYP2C19ANPEPPRMT3CARM1
SCHEMBL19214722 0.77 KDM4E (0.47) CYP2C19KDM4CKDM5AKDM4EPAOX
SCHEMBL1844564 0.77 PRMT3 (0.42) CYP2C9CYP2C19ANPEPPRMT3CARM1
SCHEMBL25356442 0.77 MEN1 (0.35) KDM7APHF8KDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121600-B1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2012-07-18 EP claimed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US claimed
EP-2121600-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS Boehringer Ingelheim International GmbH (DE) 2009-11-25 EP claimed
WO-2008099000-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-08-21 WO claimed
CN-117917989-A Use of a reversible metal electrodeposited electrolyte with pH-adjustable, dynamic glass element with high opacity and excellent rest stability, and electrolyte useful therefor 代表内华达大学雷诺分校的内华达高等教育系统董事会 2024-04-23 CN disclosed
WO-2023133645-A1 RADIOLABELED COMPOUNDS FOR IMAGING OF FIBROBLAST ACTIVATION PROTEIN (FAP) AND TREATMENT OF FAP-RELATED DISORDERS PROVINCIAL HEALTH SERVICES AUTHORITY (CA) 2023-07-20 WO disclosed
CN-110357863-B Triazine double aromatic ring derivative epidermal growth factor inhibitor and preparation method and application thereof 药雅科技(上海)有限公司 2023-04-14 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-111777599-A Quinazoline, pyridopyrimidine or bipyrimidine bi-aromatic ring derivative EGFR inhibitor and preparation method and application thereof 药雅科技(上海)有限公司 2020-10-16 CN disclosed
CN-111574503-A Pyrimidine double aromatic ring derivative epidermal growth factor inhibitor and preparation method and application thereof 药雅科技(上海)有限公司 2020-08-25 CN disclosed
US-10428043-B2 Green oxidation catalytic system TRUSTEES OF BOSTON UNIVERSITY (US) 2019-10-01 US disclosed
US-9518092-B2 Template-fixed beta-hairpin peptidomimetics with CXCR4 antagonizing activity POLYPHOR LTD. (CH) 2016-12-13 US disclosed
WO-2008087189-A2 PEPTIDES FOR USE IN THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2008-07-24 WO disclosed
WO-2008087186-A2 PEPTIDES FOR USE IN THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2008-07-24 WO disclosed
WO-2008087188-A2 PEPTIDES FOR USE IN THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2008-07-24 WO disclosed
WO-2008087187-A1 PEPTIDES FOR USE IN THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2008-07-24 WO disclosed
US-20070078079-A1 Template-fixed beta-hairpin peptidomimetics with cxcr4 antagonizing activity POLYPHOR LTD. (CH) 2007-04-05 US disclosed
EP-1622931-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH CXCR4 ANTAGONIZING ACTIVITY Polyphor AG (CH) 2006-02-08 EP disclosed
WO-2004096840-A1 TEMPLATE- FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH CXCR4 ANTAGONIZING ACTIVITY POLYPHOR AG (CH) 2004-11-11 WO disclosed
US-5366954-A Bathing in storage solution to extend bloom life EPITOPE, INC. (US) 1994-11-22 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 (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-20070078079-A1 Template-fixed beta-hairpin peptidomimetics with cxcr4 antagonizing activity CXCR4, CXCL12, CCR5 CYP2C9 4787/4885CYP2C19 4485/4885KDM4A 4648/4885
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 CYP2C9 471/4885CYP2C19 700/4885KDM4A 692/4885
US-10428043-B2 Green oxidation catalytic system TKT, OGDH, SOD1 CYP2C9 363/4885CYP2C19 931/4885KDM4A 951/4885

“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.