Sugi Predict

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Butadiene

Butadiene

SCHEMBL347876

C=C(C)C(=O)OC.C=C(C)C(=O)OC.C=CC=C

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.79
▸ TSHR P16473 4/20 0.43
▸ THRB P10828 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ KEAP1 Q14145 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MGAM O43451 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ SI P14410 1/20 0.31
▸ MGAM2 Q2M2H8 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ LMNA P02545 1/20 0.30

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
Butadiene SCHEMBL27001 1.00 ALDH1A1 (0.79) ALDH1A1TSHRTHRBTDP1KEAP1
Methacrylic Acid SCHEMBL8527610 0.93 ALDH1A1 (0.68) ALDH1A1TSHRTHRBTDP1HCAR2
Benzene SCHEMBL2457906 0.93 ALDH1A1 (0.68) ALDH1A1TSHRTHRBTDP1MAPT
Acrylic Acid SCHEMBL17746703 0.91 ALDH1A1 (0.65) ALDH1A1TSHRTHRBHCAR2HSD17B10
Acrolein SCHEMBL2036537 0.90 ALDH1A1 (0.71) ALDH1A1TSHRTHRBTDP1KEAP1
SCHEMBL344339 0.90 ALDH1A1 (0.79) ALDH1A1TSHRTHRBTDP1KEAP1
SCHEMBL4390490 0.89 ALDH1A1 (1.00) ALDH1A1TSHRTHRBTDP1KEAP1
SCHEMBL1849 0.89 — —
SCHEMBL10636466 0.89 — —
SCHEMBL25261356 0.87 ALDH1A1 (0.75) ALDH1A1TSHRTHRBTDP1KEAP1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113066880-B Solar cell module 财团法人工业技术研究院 2023-05-02 — — CN claimed
CN-113066880-A Solar cell module 财团法人工业技术研究院 2021-07-02 — — CN claimed
CN-105792812-B Eye device 眼科制药公司 2020-10-23 — — CN claimed
CN-110931583-A Packaging material and module structure 财团法人工业技术研究院 2020-03-27 — — CN claimed
CN-116410735-A Photoelectric conversion compound and photoelectric conversion composition comprising same 财团法人工业技术研究院 2023-07-11 — — CN disclosed
CN-113066880-A Solar cell module 财团法人工业技术研究院 2021-07-02 — — CN disclosed
CN-113066886-A Solar cell module 财团法人工业技术研究院 2021-07-02 — — CN disclosed
CN-112961295-A Methyl methacrylate-butyl acrylate in-situ copolymerization modified asphalt 苏州科技大学 2021-06-15 — — CN disclosed
CN-105792812-B Eye device 眼科制药公司 2020-10-23 — — CN disclosed
CN-110931583-A Packaging material and module structure 财团法人工业技术研究院 2020-03-27 — — CN disclosed
US-10301444-B2 Method for producing a fibrous composite material HENKEL AG & CO. KGAA (DE) 2019-05-28 — — US disclosed
US-8790779-B2 Adhesive film or adhesive tape based on epoxides HENKEL AG & CO. KGAA (DE) 2014-07-29 — — US disclosed
US-20120156412-A1 Use of Low-Temperature Foamable Epoxide Resins in Hollow Chamber Structures HENKEL AG & CO. KGAA (DE) 2012-06-21 — — US disclosed
US-20120121878-A1 ADHESIVE FILM OR ADHESIVE TAPE BASED ON EPOXIDES HENKEL AG & CO. KGAA (DE) 2012-05-17 — — US disclosed
US-20120015188-A1 METHOD FOR PRODUCING A FIBROUS COMPOSITE MATERIAL HENKEL AG & CO. KGAA (DE) 2012-01-19 — — US disclosed
US-20110301255-A1 EPOXIDE-BASED STRUCTURAL FOAM COMPRISING THERMOPLASTIC POLYURETHANES HENKEL AG & CO. KGAA (DE) 2011-12-08 — — US disclosed
US-20110257285-A1 EPOXIDE-BASED STRUCTURAL FOAM HAVING IMPROVED TENACITY HENKEL AG & CO., KGAA (DE) 2011-10-20 — — US disclosed
CN-101912678-A Cationic polyurea cover compositions for a multi-layer golf ball ACUSHNET CO 2010-12-15 — — CN disclosed