Acetone

Acetone

SCHEMBL7024428

CC(C)=O.NNc1ccc(C(=O)O)cn1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 18/20 0.66
HCAR2 Q8TDS4 2/20 0.55
GABRP O00591 1/20 0.52
GABRD O14764 1/20 0.52
GABRA1 P14867 1/20 0.52
GABRB1 P18505 1/20 0.52
GABRG2 P18507 1/20 0.52
GABRB3 P28472 1/20 0.52
GABRA5 P31644 1/20 0.52
GABRA3 P34903 1/20 0.52
GABRA2 P47869 1/20 0.52
GABRB2 P47870 1/20 0.52
GABRA4 P48169 1/20 0.52
GABRE P78334 1/20 0.52
GABRA6 Q16445 1/20 0.52
GABRG1 Q8N1C3 1/20 0.52
GABRG3 Q99928 1/20 0.52
GABRQ Q9UN88 1/20 0.52
P4HA1 P13674 1/20 0.50
P4HTM Q9NXG6 1/20 0.50

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
SCHEMBL158601 0.94 HCAR3 (0.67) HCAR3HCAR2GABRPGABRDGABRA1
SCHEMBL29505896 0.94 HCAR3 (0.67) HCAR3HCAR2GABRPGABRDGABRA1
Ammonia Solution, Strong SCHEMBL28249483 0.93 HCAR3 (0.65) HCAR3HCAR2GABRPGABRDGABRA1
Hydrochloric Acid SCHEMBL5789616 0.93 HCAR3 (0.65) HCAR3HCAR2GABRPGABRDGABRA1
Succinimide SCHEMBL27988812 0.88 HCAR3 (0.53) HCAR3HCAR2GABRPGABRDGABRA1
Succinic Acid SCHEMBL23070477 0.86 HCAR3 (0.57) HCAR3HCAR2GABRPGABRDGABRA1
Acetone SCHEMBL17558521 0.86 NNMT (0.69) HCAR3
SCHEMBL11005841 0.85 NNMT (0.53) HCAR3HCAR2
Acetone SCHEMBL28225377 0.83 HCAR3 (0.47) HCAR3HCAR2
Succinimide SCHEMBL28163974 0.82 HCAR3 (0.53) HCAR3HCAR2GABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11760772-B2 Functionalization and purification of molecules by reversible group exchange ILLUMINA, INC. (US) 2023-09-19 US claimed
US-20210277043-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2021-09-09 US claimed
EP-2739732-B1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA INC (US) 2020-04-22 EP claimed
US-9598453-B2 Functionalization and purification of molecules by reversible group exchange ILLUMINA, INC. (US) 2017-03-21 US claimed
US-20150353592-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2015-12-10 US claimed
US-9040678-B2 Functionalization and purification of molecules by reversible group exchange ILLUMINA, INC. (US) 2015-05-26 US claimed
CN-104160033-A Method of coupling targeting peptides to recombinant lysosomal enzymes AMICUS THERAPEUTICS INC 2014-11-19 CN claimed
EP-2739732-A2 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE Illumina, Inc. (US) 2014-06-11 EP claimed
WO-2013137922-A2 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2013-09-19 WO claimed
US-20130035480-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2013-02-07 US claimed
US-20230406874-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. 2023-12-21 US disclosed
US-11760772-B2 Functionalization and purification of molecules by reversible group exchange ILLUMINA, INC. (US) 2023-09-19 US disclosed
US-20210277043-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2021-09-09 US disclosed
US-11021504-B2 Functionalization and purification of molecules by reversible group exchange ILLUMINA, INC. (US) 2021-06-01 US disclosed
EP-3722423-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE Illumina, Inc. (US) 2020-10-14 EP disclosed
WO-2013137922-A2 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2013-09-19 WO disclosed
CN-103159854-A Connection method of antibody and microsphere UNIV ZHEJIANG 2013-06-19 CN disclosed
US-20130035480-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2013-02-07 US disclosed
EP-1315699-A2 HYDRAZINE-BASED AND CARBONYL-BASED BIFUNCTIONAL CROSSLINKING REAGENTS Solulink, Incorporated (US) 2003-06-04 EP 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 (6 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-20230406874-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE PHAX, ALKBH1, JMJD6 HCAR3 3713/4885HCAR2 3968/4885GABRP 1918/4885
US-11021504-B2 Functionalization and purification of molecules by reversible group exchange PHAX, ALKBH1, JMJD6 HCAR3 3713/4885HCAR2 3968/4885GABRP 1918/4885
US-20130035480-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE PHAX, ALKBH1, JMJD6 HCAR3 3713/4885HCAR2 3968/4885GABRP 1918/4885
US-20210277043-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE PHAX, ALKBH1, JMJD6 HCAR3 3713/4885HCAR2 3968/4885GABRP 1918/4885
US-11760772-B2 Functionalization and purification of molecules by reversible group exchange PHAX, ALKBH1, JMJD6 HCAR3 3713/4885HCAR2 3968/4885GABRP 1918/4885
US-20150353592-A1 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE PHAX, ALKBH1, JMJD6 HCAR3 3713/4885HCAR2 3968/4885GABRP 1918/4885

“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.