Acetone

Acetone

SCHEMBL2230779

C1CCOCC1.C1CCOCC1.CC(C)=O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
KMT2A Q03164 1/20 0.35
PKM P14618 1/20 0.33
GAA P10253 1/20 0.32
TSHR P16473 2/20 0.31
TTR P02766 1/20 0.31
GLA P06280 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31
PIK3CD O00329 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HTT P42858 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
Tetrahydrofuran SCHEMBL10806048 1.00 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Tetrahydrofuran SCHEMBL28186251 1.00 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Acetone SCHEMBL8877074 1.00 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Tetrahydrofuran SCHEMBL165529 0.97
Dioxane SCHEMBL10806051 0.93 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Tetrahydrofuran SCHEMBL6927933 0.93 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Tetrahydrofuran SCHEMBL11690381 0.93 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Acetic Acid SCHEMBL29037898 0.90 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Tetrahydrofuran SCHEMBL18917647 0.90 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2LMNAMEN1TP53
Acetic Acid SCHEMBL2354574 0.90 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2LMNAMEN1TP53

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-4015066-A Crystalline monosodium N6,2'-O-dibutyryl-adenosine-3',5'-cyclic monophosphate and production thereof YAMASA SHOYU KABUSHIKI KAISHA (JA) 1977-03-29 US claimed
CN-114466649-A Antibiotic-eluting poly (ester urea) membranes for infection control of implantable medical devices 阿克伦大学 2022-05-10 CN disclosed
CN-110229362-B Preparation method of toughened polyurethane film 武汉纺织大学 2021-11-19 CN disclosed
US-20210316038-A1 ANTIBIOTIC ELUTING POLY(ESTER UREA) FILMS, MESHES AND POUCHES FOR INFECTION CONTROL OF IMPLANTABLE MEDICAL DEVICES UNIV AKRON (US) 2021-10-14 US disclosed
CN-109863215-B TDI-based low viscosity polyisocyanates having isocyanurate groups 科思创德国股份有限公司 2021-08-13 CN disclosed
WO-2020226646-A1 ANTIBIOTIC ELUTING POLY (ESTER UREA) FILMS FOR INFECTION CONTROL OF IMPLANTABLE MEDICAL DEVICES THE UNIVERSITY OF AKRON (US) 2020-11-12 WO disclosed
CN-111410703-A Process for extracting heparin sodium crude product from large intestine of pig 姜德亮 2020-07-14 CN disclosed
CN-110229362-A The preparation method of toughening polyurethane film 武汉纺织大学 2019-09-13 CN disclosed
CN-108778703-A The use of microfibre and/or nanofiber in clothes and footwear 克拉考公司 2018-11-09 CN disclosed
EP-2793962-B1 PROCESS FOR MODIFYING THE SURFACE MORPHOLOGY OF A MEDICAL DEVICE LE DANG QUANG SVEND (DK) 2016-04-27 EP disclosed
EP-0049309-B1 CEPHEM DERIVATIVES, PROCESS FOR PRODUCING THEREOF, AND ANTIBACTERIAL AGENTS COMPRISING SAID COMPOUNDS Eisai Co., Ltd. (JP) 1984-05-09 EP disclosed
US-4352801-A CEPHALOSPORIN ANTIBIOTICS EISAI CO., LTD. (JP) 1982-10-05 US disclosed
US-4341797-A ANTIINFLAMMATORY AGENT E. R. SQUIBB & SONS, INC. (US) 1982-07-27 US disclosed
EP-0055256-A1 PROCESS FOR THE PRODUCTION FOR POLYISOCYANATE-POLYESTER-SILICATE PLASTIC BLOUNT, David H. (US) 1982-07-07 EP disclosed
EP-0049309-A1 Cephem derivatives, process for producing thereof, and antibacterial agents comprising said compounds Eisai Co., Ltd. (JP) 1982-04-14 EP disclosed
WO-1982000034-A1 PROCESS FOR THE PRODUCTION FOR POLYISOCYANATE-POLYESTER-SILICATE PLASTIC BLOUNT D 1982-01-07 WO disclosed
US-4211848-A UNSATURATED POLYESTER, WATER CONTAINING OXIDATED SILICON COMPOUND BLOUNT DAVID H (US) 1980-07-08 US disclosed
US-4064344-A ANTIBIOTIC MERCK & CO., INC. (US) 1977-12-20 US disclosed
US-3981831-A REACTION OF ORGANIC POLYISOCYANATE WITH ALKALI METAL SILICATE OR SILICA SOL BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 US disclosed
US-3974151-A Cephalosporin compounds MERCK & CO., INC. (US) 1976-08-10 US disclosed