SCHEMBL22290232

SCHEMBL22290232

O=C1N[C@H]2[C@H](CS[C@H]2CCCCC(=O)OOC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)N1

nearest known ligand 0.82

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.82
MEN1 O00255 1/20 0.77
ABL1 P00519 1/20 0.77
LMNA P02545 1/20 0.77
PKM P14618 1/20 0.77
IDE P14735 1/20 0.77
MAPK1 P28482 1/20 0.77
KMT2A Q03164 1/20 0.77
RIN1 Q13671 1/20 0.77
L3MBTL1 Q9Y468 1/20 0.77
HLCS P50747 6/20 0.68
CA12 O43570 5/20 0.55
CA1 P00915 5/20 0.55
CA2 P00918 5/20 0.55
CA9 Q16790 5/20 0.55
HPSE Q9Y251 1/20 0.52

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
SCHEMBL21176811 0.93 TDP1 (0.81) TDP1MEN1ABL1LMNAPKM
SCHEMBL21114407 0.93 TDP1 (0.81) TDP1MEN1ABL1LMNAPKM
SCHEMBL28119479 0.93 TDP1 (0.81) TDP1MEN1ABL1LMNAPKM
SCHEMBL28283183 0.93 TDP1 (0.81) TDP1MEN1ABL1LMNAPKM
SCHEMBL22265330 0.92 TDP1 (0.79) TDP1MEN1ABL1LMNAPKM
SCHEMBL23065674 0.91 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL19267509 0.91 TDP1 (1.00) TDP1MEN1ABL1LMNAPKM
SCHEMBL132274 0.91 TDP1 (1.00) TDP1MEN1ABL1LMNAPKM
SCHEMBL21488759 0.91 TDP1 (1.00) TDP1MEN1ABL1LMNAPKM
SCHEMBL20844951 0.91 TDP1 (1.00) TDP1MEN1ABL1LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4269604-A2 BIOELECTRONIC CIRCUITS, SYSTEMS AND METHODS FOR PREPARING AND USING THEM Arizona Board of Regents on behalf of Arizona State University (US) 2023-11-01 EP disclosed
US-20220098635-A1 BIOELECTRONIC CIRCUITS, SYSTEMS AND METHODS FOR PREPARING AND USING THEM ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2022-03-31 US disclosed
EP-3918329-A2 BIOELECTRONIC CIRCUITS, SYSTEMS AND METHODS FOR PREPARING AND USING THEM Arizona Board of Regents on behalf of Arizona State University (US) 2021-12-08 EP disclosed
WO-2020160300-A9 BIOELECTRONIC CIRCUITS, SYSTEMS AND METHODS FOR PREPARING AND USING THEM ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2020-10-29 WO disclosed
WO-2020160300-A2 BIOELECTRONIC CIRCUITS, SYSTEMS AND METHODS FOR PREPARING AND USING THEM LINDSAY STUART (US) 2020-08-06 WO disclosed
CN-108524938-B Application of CDK6 small-molecule inhibitor in reducing tolerance of liver cancer cells to antitumor drugs or radiotherapy 深圳大学 2020-06-19 CN disclosed
CN-108524938-A CDK6 micromolecular inhibitors are reducing liver cancer cells to the application in the tolerance of antineoplastic or radiotherapy 深圳大学 2018-09-14 CN disclosed
CN-102171364-A A fluid test strip and method thereof ACTHERM INC 2011-08-31 CN disclosed
CN-101111761-A Method, system and apparatus for obtaining electrochemical measurements RAPID LAB MICROSYSTEMS INC (CA) 2008-01-23 CN disclosed
CN-101060845-A Compounds and methods for treating insulin resistance and cardiomyopathy FORBES MEDI TECH RES INC (US) 2007-10-24 CN disclosed