SCHEMBL4631299

SCHEMBL4631299

N=C(N)NCC(O)CO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL17030089 1.00
Hydrochloric Acid SCHEMBL27882889 0.98 LMNA (0.36)
Hydrochloric Acid SCHEMBL17022784 0.98 LMNA (0.36)
SCHEMBL17030143 0.81 THRB (0.40)
SCHEMBL15373451 0.78
SCHEMBL15373196 0.78
SCHEMBL17029961 0.78 PTPN1 (0.35)
SCHEMBL17523047 0.77 MEN1 (0.30)
SCHEMBL17029985 0.76 THRB (0.40)
SCHEMBL14700172 0.75

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
EP-3430000-B1 PYRIMIDINES AND VARIANTS THEREOF, AND USES THEREFOR AFFERENT PHARMACEUTICALS INC (US) 2022-12-28 EP disclosed
US-10822311-B2 Pyrimidines and variants thereof, and uses therefor Afferent Pharmaceuticals, Inc. (US) 2020-11-03 US disclosed
WO-2017160569-A1 PYRIMIDINES AND VARIANTS THEREOF, AND USES THEREFOR AFFERENT PHARMACEUTICALS INC. (US) 2017-09-21 WO disclosed
US-20150250217-A1 SALTY TASTE-ENHANCING AGENT AND MANUFACTURING METHOD THEREFOR, AND SALTY TASTE-ENHANCING METHOD NISSAN FOODS HOLDINGS CO., LTD. (JP) 2015-09-10 US disclosed
EP-2910130-A1 SALTY TASTE-ENHANCING AGENT AND MANUFACTURING METHOD THEREFOR, AND SALTY TASTE-ENHANCING METHOD Nissin Foods Holdings Co., Ltd. (JP) 2015-08-26 EP disclosed
EP-1924565-A1 DIAMINOPYRIMIDINES AS P2X3 AND P3X2/3 MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2008-05-28 EP disclosed
WO-2007025900-A1 DIAMINOPYRIMIDINES AS P2X3 AND P3X2/3 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2007-03-08 WO disclosed
WO-2000012454-A9 NOVEL POLYCATIONIC LIPIDS HACES ALBERTO (US) 2000-06-15 WO disclosed
WO-2000012454-A1 NOVEL POLYCATIONIC LIPIDS HACES ALBERTO (US) 2000-03-09 WO disclosed
WO-1997042819-A9 CATIONIC LIPIDS FOR TRANSFECTION OF NEGATIVELY CHARGED OR NEUTRAL MOLECULES INTO LIVING CELLS 1998-03-12 WO disclosed
WO-1997042819-A1 CATIONIC LIPIDS FOR TRANSFECTION OF NEGATIVELY CHARGED OR NEUTRAL MOLECULES INTO LIVING CELLS HACES ALBERTO (US) 1997-11-20 WO disclosed