Butanone

Butanone

SCHEMBL3857935

CCC(C)=O.CCC(O)OC

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TDP1 Q9NUW8 4/20 0.50
TSHR P16473 3/20 0.43
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
HSD17B10 Q99714 2/20 0.31
LMNA P02545 1/20 0.31
FFAR3 O14843 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 1/20 0.30

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
Butanone SCHEMBL3678047 0.98 ALDH1A1 (0.48) ALDH1A1TDP1TSHRMGAMGAA
Acetone SCHEMBL7668393 0.90 TSHR (0.48) ALDH1A1TDP1TSHRMGAMGAA
Acetic Acid SCHEMBL29076 0.87 TSHR (0.46) ALDH1A1TDP1TSHRMGAMGAA
Acetic Acid Methyl Ester SCHEMBL3409715 0.85 ALDH1A1 (0.50) ALDH1A1TDP1TSHRMGAMGAA
SCHEMBL16668528 0.84
SCHEMBL20648 0.84
SCHEMBL13611580 0.84
SCHEMBL5487434 0.81
Methyl Alcohol SCHEMBL14861497 0.81
Magnesium SCHEMBL31182158 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9993997-B2 Laminate and process for producing same MITSUBISHI CABLE INDUSTRIES, LTD. (JP) 2018-06-12 US disclosed
EP-2962843-B1 LAMINATE AND PROCESS FOR PRODUCING SAME MITSUBISHI CABLE IND LTD (JP) 2017-05-31 EP disclosed
US-20160001523-A1 LAMINATE AND PROCESS FOR PRODUCING SAME MITSUBISHI CABLE INDUSTRIES, LTD. (JP) 2016-01-07 US disclosed
EP-2962843-A1 LAMINATE AND PROCESS FOR PRODUCING SAME Mitsubishi Cable Industries, Ltd. (JP) 2016-01-06 EP disclosed
US-20090280331-A1 PHOSPHORUS-CONTAINING BENZOXAZINE COMPOUND, PROCESS FOR PRODUCTION THEREOF, CURABLE RESIN COMPOSITION, CURED ARTICLE, AND LAMINATE PLATE SHOWA HIGHPOLYMER CO., LTD. (JP) 2009-11-12 US disclosed
US-20090274916-A1 PHOSPHORUS-CONTAINING BENZOXAZINE COMPOUND, PROCESS FOR PRODUCTION THEREOF, CURABLE RESIN COMPOSITION, CURED ARTICLE, AND LAMINATE PLATE SHOWA HIGHPOLYMER CO., LTD (JP) 2009-11-05 US disclosed
EP-2050756-A1 PHOSPHORUS-CONTAINING BENZOXAZINE COMPOUND, PROCESS FOR PRODUCTION THEREOF, CURABLE RESIN COMPOSITION, CURED ARTICLE, AND LAMINATE PLATE SHOWA HIGHPOLYMER CO., LTD. (JP) 2009-04-22 EP disclosed
EP-2048147-A1 PHOSPHORUS-CONTAINING BENZOXAZINE COMPOUND, PROCESS FOR PRODUCTION THEREOF, CURABLE RESIN COMPOSITION, CURED ARTICLE, AND LAMINATE PLATE SHOWA HIGHPOLYMER CO., LTD. (JP) 2009-04-15 EP disclosed
US-6376053-B1 BLEND OF EPOXY RESIN AND CURING AGENTS AJINOMOTO CO., INC. (JP) 2002-04-23 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-20090274916-A1 PHOSPHORUS-CONTAINING BENZOXAZINE COMPOUND, PROCESS FOR PRODUCTION THEREOF, CURABLE RESIN COMPOSITION, CURED ARTICLE, AND LAMINATE PLATE P2RX5, P2RX4, KDM5A ALDH1A1 2049/4885TDP1 906/4885TSHR 4464/4885
US-20090280331-A1 PHOSPHORUS-CONTAINING BENZOXAZINE COMPOUND, PROCESS FOR PRODUCTION THEREOF, CURABLE RESIN COMPOSITION, CURED ARTICLE, AND LAMINATE PLATE P2RX5, KDM5A, P2RX4 ALDH1A1 1946/4885TDP1 1097/4885TSHR 4511/4885

“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.