Acetone

Acetone

SCHEMBL20164099

CC(C)=O.NN.NNc1ccc(C(=O)O)c(N2C(=O)CCC2=O)n1

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
POLB P06746 3/20 0.32
GLA P06280 2/20 0.32
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 0.32
GABRA3 P34903 2/20 0.32
GABRA2 P47869 2/20 0.32
GABRB2 P47870 2/20 0.32
GABRA4 P48169 2/20 0.32
GABRE P78334 2/20 0.32
GABRA6 Q16445 2/20 0.32
GABRG1 Q8N1C3 2/20 0.32
GABRG3 Q99928 2/20 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 SCHEMBL4249268 0.99 CA12 (0.36) CA12CA1CA9POLBGLA
SCHEMBL5667071 0.95 CA12 (0.38) CA12CA1CA9POLBGABRP
Hydrochloric Acid SCHEMBL7268096 0.93 CA12 (0.37) CA12CA1CA9POLBGABRP
SCHEMBL15634880 0.83 NNMT (0.33) CA12CA1CA9CYP2C19RAB9A
SCHEMBL1845191 0.73 GAA (0.42) CA12CA1CA9ALDH1A1GAA
Acetone SCHEMBL5494665 0.72 RECQL (0.54) GLACYP2C19KDM4EALDH1A1MEN1
SCHEMBL23832214 0.69 GABRP (0.59) POLBGABRPGABRDGABRA1GABRB1
Acetone SCHEMBL17273898 0.68 KDM4E (0.35) CA12CA1CA9GABRPGABRD
SCHEMBL1845186 0.66 CA12 (0.31) CA12CA1CA9GABRPGABRD
Acetone SCHEMBL2190153 0.66 KDM4E (0.35) CA12CA1CA9GABRPGABRD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10982266-B2 Nucleic acid-polymer conjugates for bright fluorescent tags CARNEGIE MELLON UNIVERSITY (US) 2021-04-20 US disclosed
US-20180142288-A1 NUCLEIC ACID-POLYMER CONJUGATES FOR BRIGHT FLUORESCENT TAGS CARNEGIE MELLON UNIVERSITY 2018-05-24 US 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 (2 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-10982266-B2 Nucleic acid-polymer conjugates for bright fluorescent tags DNTT, NCL, POLI CA12 2060/4885CA1 3066/4885CA9 3084/4885
US-20180142288-A1 NUCLEIC ACID-POLYMER CONJUGATES FOR BRIGHT FLUORESCENT TAGS DNTT, NCL, POLI CA12 2060/4885CA1 3066/4885CA9 3084/4885

“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.