SCHEMBL9936128

SCHEMBL9936128

CC1(COc2cccc(OCC3(C)COC3)c2)COC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.46
DCPS Q96C86 1/20 0.46
ALDH1A1 P00352 3/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
PDE2A O00408 1/20 0.41
PDE10A Q9Y233 1/20 0.41
FLT3 P36888 4/20 0.41
ACACB O00763 1/20 0.40
IRAK1 P51617 2/20 0.40
IRAK4 Q9NWZ3 2/20 0.40
FFAR1 O14842 4/20 0.39
BACE1 P56817 2/20 0.39
GAK O14976 1/20 0.39
RIPK2 O43353 1/20 0.39
ULK1 O75385 1/20 0.39
STK10 O94804 1/20 0.39

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
SCHEMBL12877672 0.92 DHFR (0.41) DHFRDCPSALDH1A1TP53CYP3A4
SCHEMBL13726105 0.90 ACHE (0.43) DHFRDCPSALDH1A1TSHRPDE2A
SCHEMBL3048952 0.87 ACACB (0.44) DHFRDCPSALDH1A1PDE2APDE10A
SCHEMBL9935890 0.84 ACACB (0.50) DHFRDCPSPDE2APDE10AFLT3
SCHEMBL7187755 0.83 AGXT (0.47) DHFRDCPSSMN1; SMN2PDE2APDE10A
SCHEMBL5706342 0.82 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL36036 0.79 TSHR (0.45) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL14814333 0.78 DHFR (0.39) DHFRDCPSPDE2APDE10AFLT3
SCHEMBL18003789 0.78 ACACB (0.38) DHFRDCPSPDE2APDE10AFLT3
SCHEMBL18482078 0.78 ACACB (0.38) DHFRDCPSSMN1; SMN2PDE2APDE10A

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
US-11958971-B2 Photocurable composition, method for producing concave-convex structure, method for forming fine concave-convex pattern, and concave-convex structure MITSUI CHEMICALS, INC. (JP) 2024-04-16 US disclosed
CN-110741463-B Method for producing substrate with fine concave-convex pattern, resin composition, and laminate 三井化学株式会社 2024-02-20 CN disclosed
US-11886119-B2 Material for forming underlayer film, resist underlayer film, method of producing resist underlayer film, and laminate MITSUI CHEMICALS, INC. (JP) 2024-01-30 US disclosed
CN-110709774-B Underlayer film forming material, resist underlayer film, method for producing resist underlayer film, and laminate 三井化学株式会社 2023-12-08 CN disclosed
CN-113574086-B Photocurable composition, method for producing uneven structure, method for forming fine uneven pattern, and uneven structure 三井化学株式会社 2023-11-07 CN disclosed
US-20230185195-A1 MATERIAL FOR FORMING UNDERLAYER FILM, RESIST UNDERLAYER FILM, METHOD OF PRODUCING RESIST UNDERLAYER FILM, AND LAMINATE MITSUI CHEMICALS, INC. (JP) 2023-06-15 US disclosed
US-11599025-B2 Resin material for forming underlayer film, resist underlayer film, method of producing resist underlayer film, and laminate MITSUI CHEMICALS, INC. (JP) 2023-03-07 US disclosed
US-11597910-B2 Medical instrument, cell culture method, fluorine-containing cyclic olefin polymer and fluorine-containing cyclic olefin polymer composition for it, and cultured cells MITSUI CHEMICALS, INC. (JP) 2023-03-07 US disclosed
US-11474429-B2 Method of producing substrate with fine uneven pattern, resin composition, and laminate MITSUI CHEMICALS, INC. (JP) 2022-10-18 US disclosed
EP-3998298-A1 PHOTOCURABLE COMPOSITION, PRODUCTION METHOD FOR UNEVEN STRUCTURAL BODY, METHOD FOR FORMING MINUTE UNEVEN PATTERN, AND UNEVEN STRUCTURAL BODY Mitsui Chemicals, Inc. (JP) 2022-05-18 EP disclosed
US-20140264165-A1 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF HENKEL CORPORATION (US) 2014-09-18 US disclosed
US-20140264165-A1 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF HENKEL CORPORATION (US) 2014-09-18 US disclosed
US-20140209951-A1 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF Henkel IP & Holding GmbH (DE) 2014-07-31 US disclosed
US-20140209951-A1 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF Henkel IP & Holding GmbH (DE) 2014-07-31 US disclosed
US-20140021648-A1 IMPRINT PRODUCT AND METHOD FOR PRODUCING THE SAME MITSUI CHEMICALS, INC. (JP) 2014-01-23 US disclosed
WO-2013049154-A2 OXETANE-CONTAINING COMPOUNDS AND COMPOSITIONS THEREOF HENKEL AG & CO. KGAA (DE) 2013-04-04 WO disclosed
US-20120156448-A1 FLUORINE-CONTAINING CYCLIC OLEFIN POLYMER COMPOSITION, IMPRINT PRODUCT OBTAINED USING THE COMPOSITION, AND METHOD FOR PRODUCING THE SAME MITSUI CHEMICALS INC (JP) 2012-06-21 US disclosed
US-20110301313-A1 IMPRINT PRODUCT AND METHOD FOR PRODUCING THE SAME MITSUI CHEMICALS, INC. (JP) 2011-12-08 US disclosed
EP-1866360-B1 RADIATION-OR THERMALLY-CURABLE OXETANE BARRIER SEALANTS HENKEL AG & CO KGAA (DE) 2011-05-25 EP disclosed
EP-1992654-A1 Radiation- or thermally-curable oxetane barrier sealants National Starch and Chemical Investment Holding Corporation (US) 2008-11-19 EP disclosed