SCHEMBL782702

SCHEMBL782702

CC(C)CC(C)C(=O)C(C)CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.43
SLC7A5 Q01650 1/20 0.43
ALDH1A1 P00352 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
CACNA2D1 P54289 2/20 0.37
CACNB3 P54284 1/20 0.37
CACNA1C Q13936 1/20 0.37
PGR P06401 1/20 0.37
ADRA1A P35348 1/20 0.37
HTR2B P41595 1/20 0.37
CACNA2D2 Q9NY47 1/20 0.37
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
ANPEP P15144 3/20 0.36
LAP3 P28838 2/20 0.36
ERAP1 Q9NZ08 1/20 0.36
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL6421233 0.88 RNPEP (0.40) RNPEPSLC7A5ALDH1A1TDP1CACNA2D1
SCHEMBL6426533 0.88 RNPEP (0.40) RNPEPSLC7A5ALDH1A1TDP1CACNA2D1
SCHEMBL20457288 0.87 RNPEP (0.46) RNPEPSLC7A5ALDH1A1SLC1A3SLC1A2
SCHEMBL4662945 0.78
SCHEMBL14986913 0.78
SCHEMBL1369119 0.78
SCHEMBL2601836 0.78
SCHEMBL275847 0.78
SCHEMBL13971408 0.78
SCHEMBL275848 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3275039-B1 ELECTROLYTES AND METAL HYDRIDE BATTERIES BASF CORP (US) 2025-08-27 EP claimed
CN-118338782-A Biocidal compositions 巴斯夫欧洲公司 2024-07-12 CN claimed
CN-118325209-A Rolling oil-resistant rubber material and preparation method of rubber roller 沈阳东阳聚氨酯有限公司 2024-07-12 CN claimed
WO-2023087993-A1 ION EXCHANGE LIQUID FILM FLOW BATTERY 西湖大学 2023-05-25 WO claimed
CN-116041128-A Method and system for preparing 4-methyl-1-pentene from 4-methyl-2-pentanone 中国石油化工股份有限公司 2023-05-02 CN claimed
CN-107615556-B Electrolyte and metal hydride battery 巴斯夫公司 2021-11-02 CN claimed
EP-3337790-A1 PROCESS TO PREPARE HYDROXYMETHYLFURFURAL DERIVATIVES GFBiochemicals Limited (MT) 2018-06-27 EP claimed
CN-108191592-A A kind of method that micro passage reaction carries out aldol reaction 大连韦德生化科技有限公司 2018-06-22 CN claimed
WO-2017034985-A1 PROCESS TO PREPARE HYDROXYMETHYLFURFURAL DERIVATIVES GFBIOCHEMICALS LIMITED (MT) 2017-03-02 WO claimed
US-20160285130-A1 Electrolytes and Metal Hydride Batteries U.S. DEPARTMENT OF ENERGY 2016-09-29 US claimed
EP-0084527-A2 Process for producing paraphenylenediamine mixtures MONSANTO COMPANY (US) 1983-07-27 EP claimed
EP-0017396-B1 HEPTENO-NITRILES, PROCESS FOR THEIR PREPARATION AND PERFUMERY COMPOSITIONS CONTAINING THEM BUSH BOAKE ALLEN Limited (GB) 1983-06-01 EP claimed
US-4317752-A POLYURETHANE FOAMS; INSULATION; CONSTRUCTION MATERIALS BLOUNT DAVID H 1982-03-02 US claimed
US-4280006-A Process for the production of polyisocyanate silicate plastics utilizing an alkali metal cellulose silicate condensation product BLOUNT DAVID H 1981-07-21 US claimed
US-4262108-A FIREPROOF CONSTRUCTION MATERIALS, INSULATION BLOUNT DAVID H 1981-04-14 US claimed
US-4238375-A Process for the production of organic halosilicon acid resinous products and their reaction products utilizing phenol compounds BLOUNT DAVID H 1980-12-09 US claimed
EP-0017396-A1 Hepteno-nitriles, process for their preparation and perfumery compositions containing them BUSH BOAKE ALLEN Limited (GB) 1980-10-15 EP claimed
US-4198491-A Process for the production of organic halosilicon acid resinous products and their reaction products BLOUNT DAVID H 1980-04-15 US claimed
US-4153764-A Process for the production of polyisocyanate organic silicate solid/cellular solid product BLOUNT DAVID H 1979-05-08 US claimed
US-3981831-A REACTION OF ORGANIC POLYISOCYANATE WITH ALKALI METAL SILICATE OR SILICA SOL BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 US claimed