SCHEMBL12743

SCHEMBL12743

O=C1CCSc2ccc(F)cc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VHL P40337 1/20 0.64
ELOC Q15369 1/20 0.64
ELOB Q15370 1/20 0.64
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
CTSL P07711 1/20 0.48
HTT P42858 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 2/20 0.46
NPY1R P25929 1/20 0.44
NPY2R P49146 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
NOTUM Q6P988 1/20 0.40
AURKA O14965 1/20 0.40
CHEK2 O96017 1/20 0.40
CDK1 P06493 1/20 0.40
PIM1 P11309 1/20 0.40
FGFR1 P11362 1/20 0.40
CDK2 P24941 1/20 0.40

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
SCHEMBL29595944 1.00 VHL (0.64) VHLELOCELOBALDH1A1KDM4E
SCHEMBL5118761 0.89 VHL (0.51) VHLELOCELOBALDH1A1KDM4E
SCHEMBL2223179 0.85 KDM4E (0.58) VHLELOCELOBALDH1A1KDM4E
SCHEMBL4152484 0.81 NOTUM (0.49) VHLELOCELOBALDH1A1CTSL
SCHEMBL21038005 0.78 VHL (0.51) VHLELOCELOBALDH1A1KDM4E
SCHEMBL69544 0.78 VHL (1.00) VHLELOCELOBALDH1A1KDM4E
SCHEMBL6592045 0.78 VHL (0.64) VHLELOCELOBALDH1A1KDM4E
SCHEMBL69249 0.78 VHL (0.64) VHLELOCELOBALDH1A1KDM4E
SCHEMBL10720643 0.78 VHL (0.64) VHLELOCELOBALDH1A1KDM4E
SCHEMBL13349612 0.78 CTSL (0.48) VHLELOCELOBALDH1A1CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110698456-A Synthesis method of 2, 3-dihydrothiochromen-4-one and derivatives thereof 重庆医药高等专科学校 2020-01-17 CN claimed
CN-102086212-A Antifungal agent-2, 3,4, 5-tetrahydro-4H-benzo [ b ] thiopyrano [4,3-c ] pyrazole-2-carboxamide derivatives UNIV SHENYANG PHARMACEUTICAL 2011-06-08 CN claimed
US-20090197167-A1 Fluorinated Additives For Lithium Ion Batteries SOLVAY FLUOR GMBH (DE) 2009-08-06 US claimed
US-10106492-B2 Fluorinated carbonyl compounds comprising a triple bond, methods for their manufacture and uses thereof SOLVAY SA (BE) 2018-10-23 US disclosed
US-9969673-B2 Process for the manufacture of 1, 1′-difluorosubstituted dialkyl carbonates, isomers thereof and electrolyte compositions containing them SOLVAY S.A. (BE) 2018-05-15 US disclosed
CN-104080780-B Derivative, its preparation method and its purposes as solvent additive of the meldrum's acid of fluorination 索尔维公司 2018-04-13 CN disclosed
EP-2788313-B1 PROCESS FOR THE MANUFACTURE OF 1,1'-DIFLUOROSUBSTITUTED DIALKYL CARBONATES SOLVAY (BE) 2018-02-21 EP disclosed
US-9882198-B2 High performance lithium battery electrodes by self-assembly processing THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2018-01-30 US disclosed
US-9825331-B2 Fluorinated derivatives of meldrum's acid, a method for the preparation of the same, and their use as a solvent additive SOLVAY SA (BE) 2017-11-21 US disclosed
CN-104428941-B The carbonyls of fluorination comprising three keys, its manufacture method and application thereof 索尔维公司 2017-10-13 CN disclosed
EP-2785703-B1 5-Fluorinated derivatives of Meldrum's acid (5-fluoro-1,3-dioxane-4,6-dione derivatives), methods for their preparation and their use as solvent additives in lithium ion batteries. SOLVAY (BE) 2017-01-11 EP disclosed
US-4431816-A FUNGICIDES; BACTERICIDES SCHERING CORPORATION (US) 1984-02-14 US disclosed
US-4282229-A FOR DIABETIC COMPLICATIONS PFIZER INC. (US) 1981-08-04 US disclosed
US-4258054-A ANTIDIABETIC PFIZER INC. (US) 1981-03-24 US disclosed
US-4210756-A Tetrahydroquinoline hydantoins for chronic diabetic complications PFIZER INC. (US) 1980-07-01 US disclosed
US-4209630-A ANTIDIABETIC AGENTS PFIZER INC. (US) 1980-06-24 US disclosed
US-4177282-A ANITDIABETIC PFIZER INC. (US) 1979-12-04 US disclosed
US-4147795-A ENZYME INHIBITORS PFIZER INC. (US) 1979-04-03 US disclosed
US-4130714-A SPIRO CHROMANS OR THIOCHROMANS PFIZER INC. (US) 1978-12-19 US disclosed
US-4117230-A ANTIDIABETIC AGENTS PFIZER INC. (US) 1978-09-26 US disclosed