SCHEMBL1757441

SCHEMBL1757441

CC(C)ONC(N)=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
SCHEMBL14876899 0.79 TSHR (0.36)
SCHEMBL2273257 0.77
SCHEMBL9705269 0.77
SCHEMBL1561818 0.77
Hydrochloric Acid SCHEMBL28924805 0.74
SCHEMBL12989501 0.74 KMT2A (0.33)
SCHEMBL1757440 0.74
SCHEMBL9073436 0.74
SCHEMBL27688486 0.74
SCHEMBL8304899 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11014953-B2 Trigger-activatable metabolic sugar precursors for cancer-selective labeling and targeting THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-05-25 US disclosed
CN-212713307-U Solvent recovery system of isopropanol urea dewaxing technology 中国石油集团东北炼化工程有限公司 2021-03-16 CN disclosed
CN-212713307-U Solvent recovery system of isopropanol urea dewaxing technology 中国石油集团东北炼化工程有限公司 2021-03-16 CN disclosed
CN-210170887-U Settling washing tank for separating complex and oil product in urea dewaxing process CNPC NORTHEAST REFINING & CHEMICAL ENGINEERING CO., LTD. 2020-03-24 CN disclosed
CN-210170887-U Settling washing tank for separating complex and oil product in urea dewaxing process CNPC NORTHEAST REFINING & CHEMICAL ENGINEERING CO., LTD. 2020-03-24 CN disclosed
WO-2017062800-A1 TRIGGER-ACTIVATABLE METABOLIC SUGAR PRECURSORS FOR CANCER-SELECTIVE LABELING AND TARGETING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-04-13 WO disclosed
EP-2947070-A1 MULTI-TARGETED UBENIMEX PRODRUG DERIVATIVE AND PREPARATION METHOD AND USE THEREOF Weifang Bochuang International Academy of Biotechnology and Medicine (CN) 2015-11-25 EP disclosed
US-7973163-B2 Fused quinoline derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LTD. (JP) 2011-07-05 US disclosed
US-7943770-B2 Fused quinoline derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-17 US disclosed
EP-1740584-B9 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2010-06-09 EP disclosed
US-20080039452-A1 Fused Quinoline Derivative and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-14 US disclosed
CN-1976932-A Fused quinoline derivative and use thereof TAKEDA PHARMACEUTICAL (JP) 2007-06-06 CN disclosed
EP-1740584-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-01-10 EP disclosed
WO-2005105802-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-10 WO disclosed
CN-1056871-C Recovery method of dewaxing solvent for isopropanol urea FUSHUN PETROCHEMICAL INST CN PETROCHEMICAL CORP (CN) 2000-09-27 CN disclosed
CN-1055962-C Method for reclaiming solvent in process of isopropyl alcohol urea FUSHUN PETROCHEMICAL RES INST (CN) 2000-08-30 CN disclosed
CN-1055962-C Method for reclaiming solvent in process of isopropyl alcohol urea FUSHUN PETROCHEMICAL RES INST (CN) 2000-08-30 CN disclosed
CN-1055962-C Method for reclaiming solvent in process of isopropyl alcohol urea FUSHUN PETROCHEMICAL RES INST (CN) 2000-08-30 CN disclosed
CN-1151431-A Method for reclaiming solvent in process of isopropyl alcohol urea FUSHUN PETROCHEMICAL RESEARCH (CN) 1997-06-11 CN disclosed
CN-1151431-A Method for reclaiming solvent in process of isopropyl alcohol urea FUSHUN PETROCHEMICAL RESEARCH (CN) 1997-06-11 CN disclosed