SCHEMBL1758828

SCHEMBL1758828

CCCCCCC(CN=C=O)N=C=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
MAPT P10636 1/20 0.36
GPR84 Q9NQS5 8/20 0.35
CA2 P00918 1/20 0.35
FDPS P14324 3/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
FFAR1 O14842 1/20 0.33
LCK P06239 1/20 0.32
PPARD Q03181 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
CA1 P00915 1/20 0.32
LMNA P02545 1/20 0.32
LAP3 P28838 1/20 0.32

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
SCHEMBL7035961 1.00 ADH1B (0.39) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11417125 1.00 ADH1B (0.39) ADH1BADH1CADH1AADH4ADH7
SCHEMBL5349793 1.00 ADH1B (0.39) ADH1BADH1CADH1AADH4ADH7
SCHEMBL8433627 1.00 ADH1B (0.39) ADH1BADH1CADH1AADH4ADH7
SCHEMBL526789 1.00 ADH1B (0.39) ADH1BADH1CADH1AADH4ADH7
SCHEMBL27185934 0.98 ADH1B (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL6248888 0.93 NAAA (0.39) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1109764 0.92 CA2 (0.31) CA2
SCHEMBL18324263 0.86 MAPT (0.42) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11575980 0.86 MAPT (0.42) ADH1BADH1CADH1AADH4ADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110028643-A A kind of polyamide solution and preparation method thereof 美瑞新材料股份有限公司 2019-07-19 CN claimed
CN-109666115-A A kind of amino-silane terminated modified polyurethane resin and preparation method thereof 万华化学集团股份有限公司 2019-04-23 CN claimed
CN-109294215-A A kind of polyurethane resin combination material and purposes and a kind of high strength and modulus polyurethane material 万华化学集团股份有限公司 2019-02-01 CN claimed
CN-108840991-A The hydrophobic water-base polyurethane material and its preparation method and application of outer layer hydrophilic inner layer 四川大学 2018-11-20 CN claimed
CN-107118321-A One kind has high obstructing performance TPUE and preparation method thereof 东莞市吉鑫高分子科技有限公司 2017-09-01 CN claimed
CN-104017159-B A kind of powder-type aqueous polyurethane and preparation method thereof 黎明化工研究设计院有限责任公司 2017-06-06 CN claimed
EP-3083744-A1 POLYURETHANE/POLYUREAS Covestro LLC (US) 2016-10-26 EP claimed
WO-2015094892-A1 POLYURETHANE/POLYUREAS BAYER MATERIALSCIENCE LLC (US) 2015-06-25 WO claimed
US-6482523-B1 Adhesive for lamination NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) 2002-11-19 US claimed
WO-2024115352-A1 (CYCLO)ALIPHATIC POLYCARBONATE POLYOL COMPOSITION COVESTRO DEUTSCHLAND AG (DE) 2024-06-06 WO disclosed
EP-4378972-A1 (CYCLO)ALIPHATIC POLYCARBONATE POLYOL COMPOSITION Covestro Deutschland AG (DE) 2024-06-05 EP disclosed
CN-110467712-A Polyurethane resin material and its preparation method and application CHINA BUILDING MAT ACADEMY 2019-11-19 CN disclosed
CN-107488334-B A kind of compound thermoplastic elastomer and preparation method thereof 上海益弹新材料有限公司 2019-06-11 CN disclosed
CN-109824844-A The preparation method of modified polyurethane emulsion used for water color ink, modified polyurethane emulsion, water-based ink and preparation method thereof 中国科学院化学研究所 2019-05-31 CN disclosed
US-4118538-A ALKYLENE-OXIDE/URETHANE COPOLYMER AS SENSITIZER MANUFACTURE DE PRODUITS CHIMIQUES PROTEX, SOCIETE ANONYME (FR) 1978-10-03 US disclosed
US-4096127-A Anionic polyurethanes AKZONA INCORPORATED (US) 1978-06-20 US disclosed
US-4057442-A Method of disposal of pyrotechnic compositions THIOKOL CORPORATION (US) 1977-11-08 US disclosed
US-4053440-A POLYETHER-URETHANES BONNET JEAN CLAUDE 1977-10-11 US disclosed
US-3992477-A A POLYMERIZABLE SOLUTION CONTAINING A TRIESTER OF PHOSPHORIC ACID FORD MOTOR COMPANY (US) 1976-11-16 US disclosed
US-3991230-A RADIATION POLYMERIZABLE PAINT, UNSATURATED PHOSPHATE FORD MOTOR COMPANY (US) 1976-11-09 US disclosed