SCHEMBL7566192

SCHEMBL7566192

CCOS(=O)(=O)CCN1CCN(CCO)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.37
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
ALOX15 P16050 1/20 0.33
KMT2A Q03164 3/20 0.33
GAA P10253 2/20 0.33
TP53 P04637 2/20 0.33
CYP2C19 P33261 2/20 0.33
MEN1 O00255 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
HSD11B1 P28845 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL2987446 0.84 ALDH1A1 (0.38) ALDH1A1KDM4ECHRM2CHRM1KMT2A
SCHEMBL7618980 0.81 ALDH1A1 (0.42) ALDH1A1KDM4ECHRM2CHRM1KMT2A
SCHEMBL20504314 0.81 ALDH1A1 (0.38) ALDH1A1KDM4ECHRM2CHRM1KMT2A
SCHEMBL7566110 0.79 ALDH1A1 (0.35) ALDH1A1KDM4ECHRM2CHRM1KMT2A
SCHEMBL7904797 0.79 ALDH1A1 (0.44) ALDH1A1KDM4ECHRM2CHRM1KMT2A
SCHEMBL1396234 0.79 ALDH1A1 (0.45) ALDH1A1KDM4ECHRM2CHRM1ALOX15
SCHEMBL27951710 0.77 ALDH1A1 (0.44) ALDH1A1KDM4ECHRM2CHRM1ALOX15
SCHEMBL7567319 0.77 CHRM2 (0.39) ALDH1A1KDM4ECHRM2CHRM1KMT2A
Ether SCHEMBL3862938 0.77 ALDH1A1 (0.38) ALDH1A1KDM4ECHRM2CHRM1KMT2A
SCHEMBL12551186 0.77 MEN1 (0.33) ALDH1A1KMT2AMEN1NPC1

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-116376545-A Preparation of N, S co-doped red light carbon dot material and application of N, S co-doped red light carbon dot material in visual detection of heavy metal ions 贵州师范大学 2023-07-04 CN claimed
CN-113382680-A Analyte sensors using multiple enzymes and methods relating thereto 美国雅培糖尿病护理公司 2021-09-10 CN disclosed
EP-3328923-A1 PROCESS FOR PREPARING BIOCOMPATIBLE AND BIODEGRADABLE POROUS THREE-DIMENSIONAL POLYMER MATRICES AND USES THEREOF Université Paul Sabatier Toulouse III (FR) 2018-06-06 EP disclosed
WO-2002083938-A2 SCREENING METHODS FOR IDENTIFYING LIGANDS EMERALD BIOSTRUCTURES, INC. (US) 2002-10-24 WO disclosed
US-6150491-A PEROXIDATION OF AROMATIC COMPOUNDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2000-11-21 US disclosed