Acetone

Acetone

SCHEMBL44218

CC(C)=O.NNc1ccncc1C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
SIRT3 Q9NTG7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPK8 P45983 1/20 0.34
MAPK9 P45984 1/20 0.34
MAPK10 P53779 1/20 0.34
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
MGLL Q99685 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MAPT P10636 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
Acetone SCHEMBL16337585 0.99 GAA (0.37) GAAKDM4EALDH1A1GLACA12
SCHEMBL1923453 0.96 CA12 (0.38) GAAKDM4EALDH1A1GLACA12
Hydrochloric Acid SCHEMBL7062212 0.95 CA12 (0.37) GAAKDM4EALDH1A1GLACA12
SCHEMBL11036757 0.78 KDM4E (0.33) GAAKDM4EALDH1A1GLASIRT3
SCHEMBL8130177 0.78 GAA (0.36) GAAMAPK8MAPK9MAPK10MEN1
Acetone SCHEMBL538075 0.76 CNR2 (0.41) KDM4EALDH1A1TDP1MGLLMAPT
SCHEMBL15231891 0.74 RBP4 (0.43) GAAALDH1A1MGLLMAPTCYP11B2
SCHEMBL15066588 0.73 KDM4E (0.42) GAAKDM4EALDH1A1CA12CA1
Acetone SCHEMBL1019109 0.73 MAPK1 (0.40) GAAKDM4EMAPK1MGLLL3MBTL1
Acetone SCHEMBL5667714 0.73 SIRT3 (0.58) GAAKDM4EALDH1A1GLACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10953073-B2 XTEN conjugate compositions and methods of making same AMUNIX PHARMACEUTICALS, INC. (US) 2021-03-23 US claimed
EP-2494075-B1 TEMPLATED NANOCONJUGATES UNIV NORTHWESTERN (US) 2018-04-04 EP claimed
US-20130052204-A1 (POLY)-GLYCEROLPHOSPHATE-BASED ANTI-GRAM POSITIVE BACTERIAL VACCINE THE HENRY M. JACKSON FOUNDATION FOR THE ADVANCEMENT OF MILITARY MEDICINE, INC. 2013-02-28 US claimed
EP-2501403-A2 (POLY)-GLYCEROLPHOSPHATE-BASED ANTI-GRAM POSITIVE BACTERIAL VACCINE The Henry M. Jackson Foundation for the Advancement of Military Medicine, Inc. (US) 2012-09-26 EP claimed
CN-102666879-A Templated nanoconjugates UNIV NORTHWESTERN 2012-09-12 CN claimed
EP-2494075-A2 TEMPLATED NANOCONJUGATES Northwestern University (US) 2012-09-05 EP claimed
EP-2341916-A1 COLOSTRUM COMPOSITION Nanoko A/S (DK) 2011-07-13 EP claimed
WO-2011060379-A2 (POLY)-GLYCEROLPHOSPHATE-BASED ANTI-GRAM POSITIVE BACTERIAL VACCINE SNAPPER CLIFFORD M (US) 2011-05-19 WO claimed
WO-2011053940-A2 TEMPLATED NANOCONJUGATES NORTHWESTERN UNIVERSITY (US) 2011-05-05 WO claimed
EP-2249661-A2 PRODUCTS AND METHODS TO PREVENT INFECTION Multimerics APS (DK) 2010-11-17 EP claimed
WO-2010028652-A1 COLOSTRUM COMPOSITION NANOKO A/S (DK) 2010-03-18 WO claimed
WO-2010021639-A1 ATTOMOLAR PROTEIN DETECTION IN COMPLEX DAMLE MATRICES WITH SEMI-HOMOGENEOUS FLUIDIC FORCE DISCRIMINATION ASSAYS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2010-02-25 WO claimed
WO-2009092383-A2 PRODUCTS AND METHODS TO PREVENT INFECTION MULTIMERICS APS (DK) 2009-07-30 WO claimed
EP-4397755-A2 DELIVERY OF THERAPEUTIC AGENTS BY A COLLAGEN BINDING PROTEIN The Board of Trustees of the University of Arkansas (US) 2024-07-10 EP disclosed
WO-2022117731-A9 ELECTROSTATIC NANOPARTICLES AND USE THEREOF Westfälische Wilhelms-Universität Münster (DE) 2024-05-16 WO disclosed
WO-2024092126-A1 COMPOSITIONS AND METHODS FOR IMPROVED IMMUNOTHERAPIES CARGO THERAPEUTICS, INC. (US) 2024-05-02 WO disclosed
US-20030013857-A1 Hydrazine-based and carbonyl-based bifunctional crosslinking reagents SOLULINK INCORPORATED 2003-01-16 US disclosed
US-20020146504-A1 Ternary biomolecule/polymer/surface-based immobilization systems AUDAX PRIVATE DEBT LLC, AS AGENT 2002-10-10 US disclosed
WO-2002057422-A2 TERNARY BIOMOLECULE/POLYMER/SURFACE-BASED IMMOBILIZATION SYSTEMS SCHWARTZ DAVID A (US) 2002-07-25 WO disclosed
WO-2001070685-A2 HYDRAZINE-BASED AND CARBONYL-BASED BIFUNCTIONAL CROSSLINKING REAGENTS SOLULINK, INCORPORATED (US) 2001-09-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020146504-A1 Ternary biomolecule/polymer/surface-based immobilization systems EPCAM, DNPEP, ANPEP GAA 669/4885KDM4E 2841/4885ALDH1A1 552/4885
US-10953073-B2 XTEN conjugate compositions and methods of making same XPA, TXLNA, NGLY1 GAA 663/4885KDM4E 2338/4885ALDH1A1 3685/4885
US-20030013857-A1 Hydrazine-based and carbonyl-based bifunctional crosslinking reagents HLCS, DUOX1, HAO2 GAA 1579/4885KDM4E 1647/4885ALDH1A1 47/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.