SCHEMBL19732818

SCHEMBL19732818

NCCNNC(=O)O

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
SCHEMBL28167200 0.85 CA12 (0.50)
SCHEMBL8662079 0.80 PAOX (0.48)
Bicarbonate SCHEMBL10712563 0.79 LDHA (0.32)
SCHEMBL7615594 0.78
SCHEMBL11093093 0.76
SCHEMBL5548840 0.74
SCHEMBL25247140 0.74 ALOX15 (0.34)
SCHEMBL19931511 0.72 GAA (0.42)
SCHEMBL28562640 0.72
Urea SCHEMBL31542023 0.72 LMNA (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3260499-B1 COMPOSITION FOR RUBBER VIBRATION INSULATOR, AND CROSSLINKED OBJECT OBTAINED THEREFROM OSAKA SODA CO LTD (JP) 2021-06-30 EP disclosed
CN-112239451-A Preparation method of ethylene carbonate/propylene carbonate 营口恒洋新能源化工有限公司 2021-01-19 CN disclosed
WO-2020040215-A1 RESIN-CONTAINING RUBBER COMPOSITION 株式会社大阪ソーダ 2020-02-27 WO disclosed
WO-2020022451-A1 SOUND-ABSORBING MATERIAL COMPOSITION 株式会社大阪ソーダ 2020-01-30 WO disclosed
EP-3260499-A1 COMPOSITION FOR RUBBER VIBRATION INSULATOR, AND CROSSLINKED OBJECT OBTAINED THEREFROM Osaka Soda Co. Ltd. (JP) 2017-12-27 EP disclosed
CN-1033807-C Preparation of overbased magnesium sulphonates EXXON CHEMICAL PATENTS INC (US) 1997-01-15 CN disclosed
CN-1067050-A The method for making of overbased magnesium sulphonates EXXON CHEMICAL PATENTS INC (US) 1992-12-16 CN disclosed