SCHEMBL6169501

SCHEMBL6169501

CCCCOC(=O)NCCCBr

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.70
EPHX2 P34913 2/20 0.49
EPHX1 P07099 1/20 0.48

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
SCHEMBL30405136 0.95 ACHE (0.68) ACHEEPHX2EPHX1
SCHEMBL25166871 0.93 ACHE (0.71) ACHEEPHX2EPHX1
SCHEMBL2592697 0.91 ACHE (0.67) ACHEEPHX1
SCHEMBL10939707 0.88 ACHE (0.81) ACHEEPHX2EPHX1
SCHEMBL7569673 0.88 ACHE (0.81) ACHEEPHX2EPHX1
SCHEMBL3975468 0.88 ACHE (0.88) ACHEEPHX2EPHX1
SCHEMBL31122612 0.88 ACHE (0.74) ACHEEPHX2EPHX1
SCHEMBL10447924 0.86 ACHE (0.85) ACHEEPHX2EPHX1
SCHEMBL7693489 0.86 ACHE (0.78) ACHEEPHX2EPHX1
SCHEMBL473236 0.86 ACHE (0.85) ACHEEPHX2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4536653-A2 SIALIC ACID DERIVATIVES AND METHODS OF USING SAME Eisai R&D Management Co., Ltd. (JP) 2025-04-16 EP disclosed
WO-2023239906-A2 SIALIC ACID DERIVATIVES AND METHODS OF USING SAME EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-12-14 WO disclosed
EP-4161522-A1 PYRAZOLO[4,3-D]PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF CELLULAR PROLIFERATIVE DISORDERS Merck Sharp & Dohme LLC (US) 2023-04-12 EP disclosed
EP-4132583-A1 PHTHALOCYANINE DYE COMPOUNDS, CONJUGATES AND METHODS OF USE THEREOF Rakuten Medical, Inc. (US) 2023-02-15 EP disclosed
WO-2021067458-A1 PROTEIN-MACROMOLECULE CONJUGATES AND METHODS OF USE THEREOF BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2021-04-08 WO disclosed
EP-3233826-A1 NEW ANTIBACTERIAL COMPOUNDS Aziende Chimiche Riunite Angelini Francesco A.C.R. (IT) 2017-10-25 EP disclosed
WO-2016096631-A1 NEW ANTIBACTERIAL COMPOUNDS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2016-06-23 WO disclosed
EP-0997464-B1 1,3,8-Triazaspiro[4,5] decanone compounds as orl1-receptor agonists PFIZER (US) 2005-02-16 EP disclosed
US-6465478-B1 1,3,8-Triuazaspiro(4,5)decanone compounds as ORL1-receptor agonists PFIZER INC. 2002-10-15 US disclosed
CN-1351602-A Novel Pharmaceutically Active Compounds ASTRAZENECA AB (SE) 2002-05-29 CN disclosed
EP-1102762-A2 2-SUBSTITUTED-1-PIPERIDYL BENZIMIDAZOLE COMPOUNDS AS ORL1-RECEPTOR AGONISTS PFIZER INC. (US) 2001-05-30 EP disclosed
WO-2001022919-A2 SPIRO[BICYCLIC -AZACYCLOALKYL AND -CYCLOALKYL] DERIVATIVES AND USES THEREOF MERCK & CO., INC. (US) 2001-04-05 WO disclosed
WO-2000029386-A1 PYRIMIDINEDIONE DERIVATIVES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2000-05-25 WO disclosed
EP-0997464-A1 1,3,8-Triazaspiro[4,5] decanone compounds as orl1-receptor agonists PFIZER INC. (US) 2000-05-03 EP disclosed
WO-2000008013-A2 2-SUBSTITUTED-1-PIPERIDYL BENZIMIDAZOLE COMPOUNDS AS ORL1-RECEPTOR AGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2000-02-17 WO disclosed