SCHEMBL385559

SCHEMBL385559

CCCCC(C)COC=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ADH1B P00325 3/20 0.35
ADH1C P00326 3/20 0.35
ADH1A P07327 3/20 0.35
ADH7 P40394 3/20 0.35
ADH4 P08319 2/20 0.35
CYP3A4 P08684 3/20 0.34
ACE2 Q9BYF1 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CTSK P43235 5/20 0.34
SLC15A1 P46059 1/20 0.32
EPHX1 P07099 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
Hydrochloric Acid SCHEMBL29133121 0.98 TSHR (0.39) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL3042552 0.94 ADH1B (0.42) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL27855045 0.92 ADH1B (0.46) TSHRADH1BADH1CADH1AADH7
SCHEMBL28087567 0.92 ADH1B (0.46) TSHRADH1BADH1CADH1AADH7
SCHEMBL3045141 0.92 ADH1B (0.46) TSHRADH1BADH1CADH1AADH7
Hydrochloric Acid SCHEMBL28112865 0.92 ADH1B (0.41) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL103021 0.86
SCHEMBL5441114 0.85 LMNA (0.31) TSHRSMN1; SMN2
SCHEMBL21908693 0.83
SCHEMBL3038482 0.83 LMNA (0.48) ADH1BADH1CADH1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478690-B Preparation method of 6, 6-dimethyl-3-azabicyclo [3.1.0] hexane derivative 新发药业有限公司 2024-01-02 CN disclosed
CN-109071736-B Graft copolymers based on a polyolefin backbone and methacrylate side chains 赢创运营有限公司 2021-08-10 CN disclosed
CN-105441401-B A kind of monoamine oxidase and its application in synthesis of chiral Azabicyclic compounds 上海弈柯莱生物医药科技有限公司 2019-11-08 CN disclosed
CN-105441401-B A kind of monoamine oxidase and its application in synthesis of chiral Azabicyclic compounds 上海弈柯莱生物医药科技有限公司 2019-11-08 CN disclosed
CN-106459003-B Pyrazole amide derivatives 帝人制药株式会社 2019-06-21 CN disclosed
US-9677024-B2 Fuel efficient lubricating oils VANDERBILT CHEMICALS, LLC (US) 2017-06-13 US disclosed
CN-106459003-A Pyrazole amide derivatives 帝人制药株式会社 2017-02-22 CN disclosed
US-9080124-B2 Use of graft polymers EVONIK ROHMAX ADDITIVES GMBH (DE) 2015-07-14 US disclosed
US-20150133352-A1 FUEL EFFICIENT LUBRICATING OILS VANDERBILT CHEMICALS, LLC (US) 2015-05-14 US disclosed
WO-2015056062-A1 METHOD OF PROVIDING HIGH COEFFICIENTS OF FRICTION ACROSS OIL-LUBRICATED FRICTION CLUTCHES INFINEUM INTERNATIONAL LIMITED (GB) 2015-04-23 WO disclosed
EP-0490224-A2 Derivatives of salicylic aldehyde and salicylic acid, sulfphuranalogs thereof, process and intermediates for their preparation BASF Aktiengesellschaft (DE) 1992-06-17 EP disclosed
EP-0490060-A1 Salicylic acid derivatives BASF Aktiengesellschaft (DE) 1992-06-17 EP disclosed
EP-0479055-A1 Benzaldoximether derivatives BASF Aktiengesellschaft (DE) 1992-04-08 EP disclosed
US-5100458-A Pyrimidine substituted, plant growth regulators BASF AKTIENGESELLSCHAFT (DE) 1992-03-31 US disclosed
US-5085686-A Plant growth regulator BASF AKTIENGESELLSCHAFT (DE) 1992-02-04 US disclosed
US-5057143-A Herbicides, plant growth regulators BASF AKTIENGESELLSCHAFT (DE) 1991-10-15 US disclosed
EP-0435104-A2 Salicylic acid derivatives, process for their preparation and their use as herbicide and bioregulators BASF Aktiengesellschaft (DE) 1991-07-03 EP disclosed
EP-0402751-A1 Derivatives of salicylic aldehyde and salicylic acid and sulphur analoges thereof, methodes for preparing them and their use as herbicides and bioregulators BASF Aktiengesellschaft (DE) 1990-12-19 EP disclosed
EP-0346789-A2 Salicylic-acid derivatives and their sulfur analogues BASF Aktiengesellschaft (DE) 1989-12-20 EP disclosed
EP-0344557-A2 Liquid crystal components with a trimethylenoxy group F. HOFFMANN-LA ROCHE AG (CH) 1989-12-06 EP disclosed