Butanone

Butanone

SCHEMBL1454065

CCC(C)=O.CCCCO

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.65
TDP1 Q9NUW8 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.53
LMNA P02545 2/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.50
CES1 P23141 5/20 0.42
CES2 O00748 9/20 0.41
AKR1B1 P15121 1/20 0.38

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 SCHEMBL28064478 1.00 ALDH1A1 (0.65) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
Butanone SCHEMBL27524123 0.97 ALDH1A1 (0.61) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
Butanone SCHEMBL28090230 0.97 ALDH1A1 (0.61) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
Butanone SCHEMBL9706895 0.97 ALDH1A1 (0.61) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
Butanone SCHEMBL7611681 0.97 ALDH1A1 (0.61) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
Heptane SCHEMBL27952429 0.95 ALDH1A1 (0.60) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
Butanone SCHEMBL16699494 0.95 ALDH1A1 (0.58) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
1-Pentanol SCHEMBL3227511 0.92 SMN1; SMN2 (0.67) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
1-Hexanol SCHEMBL11256968 0.89 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10
Cetostearyl Alcohol SCHEMBL8386828 0.89 ALDH1A1 (0.68) ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1594332-A Glycyrrhetic acid and phospholipid composites of glycyrrhetate and process for preparing same JIANGSU CHIA TAI TIANQING PHAR (CN) 2005-03-16 CN claimed
CN-116410469-A Polysiloxane resin with strong adhesive force and preparation method thereof, nano-reinforced polysiloxane antifouling paint and preparation method thereof 集美大学 2023-07-11 CN disclosed
CN-111463004-B Surface antioxidant treatment method of low-demagnetization-rate neodymium iron boron permanent magnet powder 江苏巨鑫磁业有限公司 2021-10-01 CN disclosed
CN-108585948-B Method for modifying surface of alumina-based ceramic fiber 山东大学 2021-04-23 CN disclosed
CN-111463004-A Surface antioxidant treatment method of low-demagnetization-rate neodymium iron boron permanent magnet powder 江苏巨鑫磁业有限公司 2020-07-28 CN disclosed
CN-110709735-A Anti-dazzle film 株式会社大赛璐 2020-01-17 CN disclosed
CN-208717196-U The equipment for separating sec-butyl alcohol and methyl ethyl ketone 淄博齐翔腾达化工股份有限公司 2019-04-09 CN disclosed
CN-208604042-U Separate the device of sec-butyl alcohol and methyl ethyl ketone 淄博齐翔腾达化工股份有限公司 2019-03-15 CN disclosed
CN-108585948-A A kind of method that aluminium oxide base ceramic fibre surface is modified 山东大学 2018-09-28 CN disclosed
CN-106414063-B Gas barrier film and electronic device using same 柯尼卡美能达株式会社 2018-09-11 CN disclosed
EP-1416004-A1 Polymerizable amine mixtures, amine polymer materials and their use MERCK PATENT GmbH (DE) 2004-05-06 EP disclosed
CN-1059103-C Medicine for treating cardiovascular and cerebrovascular diseases LANG HONGZHI (CN) 2000-12-06 CN disclosed
US-6022929-A FUNCTIONALIZATION EXXON CHEMICAL PATENTS INC. (US) 2000-02-08 US disclosed
EP-0436692-B2 NOVEL COMBINED COMPOSITIONS FOR COMBATTING PESTS CHINOIN GYOGYSZER ES VEGYESZET (HU) 1999-04-21 EP disclosed
US-5814715-A LUBRICATING OIL CONCENTRATES; OIL ADDITIVES; DISPERSANTS; POLYMERIZED RAFFINATE II STREAMS USING A LEWIS ACID CATALYST AND BROMINE-CONTAINING PROMOTER EXXON CHEMICAL PATENTS INC (US) 1998-09-29 US disclosed
CN-1185331-A High-effective Naoxinning medicine for curing cerebrovascular disease LANG HONGZHI (CN) 1998-06-24 CN disclosed
US-5424327-A Mixture of pyrethroid insecticides and a fungicide which inhibits ergosterol biosynthesis; plants, animals CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT (HU) 1995-06-13 US disclosed
US-5389662-A Mixture of chinmix and propiconazole; insecticide and pesticide CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYAR RT. (HU) 1995-02-14 US disclosed
US-4704403-A HYPOTENSIVE, ANTIARRHYTHMIA BREMANIS GUNAR A (SU) 1987-11-03 US disclosed
EP-0101052-A2 Method for producing 2-substituted-thiazolidine-4-carboxylic acids AJINOMOTO CO., INC. (JP) 1984-02-22 EP disclosed