SCHEMBL323736

SCHEMBL323736

COC(=O)C(C)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
MMP1 P03956 2/20 0.42
MMP2 P08253 2/20 0.42
MMP9 P14780 2/20 0.42
MMP13 P45452 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
MMP8 P22894 1/20 0.42
F2 P00734 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 3/20 0.41
MMP3 P08254 1/20 0.40
MMP7 P09237 1/20 0.40
STAT3 P40763 1/20 0.40
CA12 O43570 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
SCHEMBL1990105 1.00 KMT2A (0.45) KMT2AMEN1MMP1MMP2MMP9
SCHEMBL323735 1.00 KMT2A (0.45) KMT2AMEN1MMP1MMP2MMP9
SCHEMBL29364700 1.00 KMT2A (0.45) KMT2AMEN1MMP1MMP2MMP9
SCHEMBL2081536 0.85 KMT2A (0.47) KMT2AMEN1CA1CA2LMNA
SCHEMBL7587366 0.85 KMT2A (0.47) KMT2AMEN1CA1CA2LMNA
SCHEMBL10254866 0.85 KMT2A (0.44) KMT2AMEN1MMP1MMP2MMP9
SCHEMBL2325747 0.85 KMT2A (0.47) KMT2AMEN1CA1CA2LMNA
SCHEMBL3089042 0.85 KMT2A (0.49) KMT2AMEN1LMNAGAASTAT3
SCHEMBL10012108 0.85 KMT2A (0.46) KMT2AMEN1MMP1MMP2MMP9
SCHEMBL10012543 0.85 KMT2A (0.48) KMT2AMEN1CA2LMNACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117865833-A metalaxyl-M and synthesis method thereof 浙江禾本科技股份有限公司 2024-04-12 CN disclosed
CN-114591261-A Synthesis method of chiral benzyl carboxylate compound 上海药坦药物研究开发有限公司 2022-06-07 CN disclosed
CN-108623455-B Intermediate of anti-heart failure medicine 成都博腾药业有限公司 2022-05-31 CN disclosed
CN-113979907-A Cyclohexane-1, 3-dione compound and application thereof 郑州恒诚仪器耗材有限公司 2022-01-28 CN disclosed
CN-111205208-B Cyclohexane-1, 3-diketone compound and synthetic method and application thereof 郑州恒诚仪器耗材有限公司 2021-12-17 CN disclosed
WO-2021143617-A1 CYCLOHEXADIENE OXIME ETHER COMPOUND, SYNTHESIS METHOD THEREFOR AND APPLICATION THEREOF 郑州手性药物研究院有限公司 2021-07-22 WO disclosed
CN-112409378-A Tricyclic PI3K inhibitor compounds and methods of use thereof 豪夫迈·罗氏有限公司 2021-02-26 CN disclosed
CN-108349996-B Tricyclic PI3K inhibitor compounds and methods of use thereof 豪夫迈·罗氏有限公司 2021-01-08 CN disclosed
CN-107174584-B Application of piperazine structure-containing compound in preparation of LSD1 inhibitor 福建金乐医药科技有限公司 2020-09-01 CN disclosed
EP-3347361-B1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE HOFFMANN LA ROCHE (CH) 2020-08-05 EP disclosed
WO-1992018467-A1 CYANOPHENOXYNAPHTHYL OXYCARBOXYLIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1992-10-29 WO disclosed
EP-0308755-B1 DERIVATIVES OF 7-(HETERO)ARYLOXY-NAPHTHALEN-2-YLOXY)ALCANOIC ACID BAYER AG (DE) 1992-10-28 EP disclosed
EP-0315008-B1 DERIVATIVES OF (6-(HETERO)ARYLOXY-NAPHTHALIN-2-YL-OXY)ALCANOIC ACID BAYER AG (DE) 1992-09-09 EP disclosed
EP-0453842-A2 Fluor subsituted derivatives of alpha-(5-aryloxy-naphthalen-1-yloxy)propionic acid BAYER AG (DE) 1991-10-30 EP disclosed
EP-0309864-B1 ALPHA-(5-ARYLOXY-NAPHTHALEN-1-YL-OXY)-PROPIONIC-ACID DERIVATIVES BAYER AG (DE) 1991-05-22 EP disclosed
EP-0347679-A1 1,7-Dioxynaphthalene derivatives BAYER AG (DE) 1989-12-27 EP disclosed
EP-0342440-A1 Halogen-substituted phenoxybenzyl-(thi)ol derivatives BAYER AG (DE) 1989-11-23 EP disclosed
EP-0315008-A2 Derivatives of (6-(hetero)aryloxy-naphthalin-2-yl-oxy)alcanoic acid BAYER AG (DE) 1989-05-10 EP disclosed
EP-0308755-A2 Derivatives of 7-(hetero)aryloxy-naphthalen-2-yloxy)alcanoic acid BAYER AG (DE) 1989-03-29 EP disclosed
US-4629493-A NONPHYTOTOXIC TO BROAD LEAF PLANTS NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-12-16 US disclosed