SCHEMBL5568281

SCHEMBL5568281

CC(OCc1ccccc1)OC(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.51
SLC1A2 P43004 2/20 0.51
SLC1A1 P43005 2/20 0.51
MEN1 O00255 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 1/20 0.51
TSHR P16473 1/20 0.47
ALDH1A1 P00352 2/20 0.47
ALOX5 P09917 1/20 0.44
PSMB5 P28074 1/20 0.44
PARP10 Q53GL7 1/20 0.44
SRR Q9GZT4 1/20 0.43
EPHX1 P07099 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALPI P09923 1/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL2380920 0.86 ALDH1A1 (0.56) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL12246308 0.86 ALDH1A1 (0.56) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL755346 0.86 ALDH1A1 (0.56) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL28004209 0.84 SLC1A3 (0.46) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL27777630 0.83 KMT2A (0.56) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL1811694 0.81 SLC6A2 (0.50) SLC1A3SLC1A2SLC1A1CYP1A2CYP2D6
SCHEMBL28914994 0.81 SLC6A2 (0.50) SLC1A3SLC1A2SLC1A1CYP1A2CYP2D6
Carbamic Acid SCHEMBL27457276 0.81 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL28237997 0.81 SLC6A2 (0.50) SLC1A3SLC1A2SLC1A1CYP1A2CYP2D6
SCHEMBL8394453 0.81 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947836-A Method for preparing furazanobenzimidazole and crystal forms thereof 巴斯利尔药物国际股份公司 2023-10-27 CN disclosed
CN-110536890-B Method for preparing furazanobenzimidazole and crystal forms thereof 巴斯利尔药物国际股份公司 2023-08-15 CN disclosed
EP-1765899-A1 METHOD FOR PRODUCING AMINO-FUNCTIONAL POLYURETHANE PREPOLYMERS Bayer MaterialScience AG (DE) 2007-03-28 EP disclosed
WO-2006002811-A1 METHOD FOR PRODUCING AMINO-FUNCTIONAL POLYURETHANE PREPOLYMERS BAYER MATERIALSCIENCE AG (DE) 2006-01-12 WO disclosed
WO-1994011353-A1 PROCESS FOR THE PREPARATION OF (3R)- AND (3S)-PIPERAZIC ACID DERIVATIVES UNIVERSITY COLLEGE LONDON (GB) 1994-05-26 WO disclosed