SCHEMBL3192546

SCHEMBL3192546

COC(=O)Cc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.58
CYP4F2 P78329 1/20 0.56
CYP4A11 Q02928 1/20 0.56
EPHX2 P34913 3/20 0.55
FFAR1 O14842 1/20 0.54
ALDH1A1 P00352 2/20 0.54
MMP9 P14780 1/20 0.53
LTA4H P09960 3/20 0.53
HPGD P15428 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KLK7 P49862 2/20 0.51
NR3C1 P04150 1/20 0.51
MAPK14 Q16539 1/20 0.50
NPC1 O15118 1/20 0.50
NPY5R Q15761 1/20 0.49
KDM4E B2RXH2 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL6242743 0.88 FFAR1 (0.53) SRD5A2EPHX2FFAR1ALDH1A1HPGD
SCHEMBL8037910 0.88 ALOX5 (0.61) FFAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL31657190 0.85 AKR1C3 (0.62) SRD5A2ALDH1A1NPC1KDM4EKMT2A
SCHEMBL5213552 0.85 SLC7A5 (0.55) FFAR1ALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL1870609 0.85 ALDH1A1 (0.62) CYP4F2CYP4A11ALDH1A1HPGDSMN1; SMN2
SCHEMBL4675 0.85 ALDH1A1 (0.62) CYP4F2CYP4A11ALDH1A1HPGDSMN1; SMN2
Benzene SCHEMBL28096336 0.85 ALDH1A1 (0.62) CYP4F2CYP4A11ALDH1A1HPGDSMN1; SMN2
SCHEMBL7558146 0.84 KMT2A (0.56) CYP4F2CYP4A11EPHX2ALDH1A1MMP9
SCHEMBL6446114 0.84 KMT2A (0.56) CYP4F2CYP4A11EPHX2ALDH1A1MMP9
SCHEMBL5924358 0.84 CYP4F2 (0.54) CYP4F2CYP4A11ALDH1A1MMP9SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109096420-B Catalyst for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN claimed
US-20230058545-A1 HCK AS A THERAPEUTIC TARGET IN MYD88 MUTATED DISEASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-02-23 US disclosed
US-20230058545-A1 HCK AS A THERAPEUTIC TARGET IN MYD88 MUTATED DISEASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-02-23 US disclosed
EP-3246317-B1 BTK INHIBITOR HUBEI BIO PHARMACEUTICAL INDUSTRIAL TECH INSTITUTE INC (CN) 2023-02-22 EP disclosed
EP-4041401-A1 HCK AS A THERAPEUTIC TARGET IN MYD88 MUTATED DISEASES Dana-Farber Cancer Institute, Inc. (US) 2022-08-17 EP disclosed
CN-109096420-B Catalyst for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN disclosed
WO-2021071919-A1 HCK AS A THERAPEUTIC TARGET IN MYD88 MUTATED DISEASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-15 WO disclosed
WO-2021071919-A1 HCK AS A THERAPEUTIC TARGET IN MYD88 MUTATED DISEASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-15 WO disclosed
US-10662174-B2 BTK inhibitor HUBEI BIO-PHARMACEUTICAL INDUSTRIAL TECHNOLOGICAL INSTITUTE, INC. (CN) 2020-05-26 US disclosed
EP-3246317-A1 BTK INHIBITOR Hubei Bio-Pharmaceutical Industrial Technological Institute Inc. (CN) 2017-11-22 EP disclosed
US-RE41135-E1 Inhibitors of the 11-β-hydroxysteroid dehydrogenase type 1 enzyme ABBOTT LABORATORIES (US) 2010-02-16 US disclosed
US-20090176783-A1 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2009-07-09 US disclosed
US-7528282-B2 for the treatment of non-insulin dependent type 2 diabetes, insulin resistance, obesity, lipid disorders, metabolic syndrome and conditions because of excessive glucocorticoid action; E-4-(2-methyl-2-phenoxy-propionylamino)-adamantane-1-carboxylic acid amide ABBOTT LABORATORIES (US) 2009-05-05 US disclosed
CN-101142172-A Inhibitors of 11-beta-hydroxysteroid dehydrogenase type 1 enzyme ABBOTT LAB (US) 2008-03-12 CN disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 EP disclosed
US-20070179186-A1 for the treatment of non-insulin dependent type 2 diabetes, insulin resistance, obesity, lipid disorders, metabolic syndrome and conditions because of excessive glucocorticoid action; E-4-(2-methyl-2-phenoxy-propionylamino)-adamantane-1-carboxylic acid amide ABBVIE INC. 2007-08-02 US disclosed
US-7217838-B2 Compounds such as E-4-{[1-(4-Chloro-phenyl)-cyclobutanecarbonyl]-amino}-adamantane-1-carboxylic acid; fortherapy of non-insulin dependent type 2 diabetes, insulin resistance, obesity, lipid disorders, metabolic syndrome and diseases and conditions that are mediated by excessive glucocorticoid action ABBOTT LABORATORIES (US) 2007-05-15 US disclosed
US-20060149070-A1 Compounds such as E-4-{[1-(4-Chloro-phenyl)-cyclobutanecarbonyl]-amino}-adamantane-1-carboxylic acid, for therapy of non-insulin dependent type 2 diabetes, insulin resistance, obesity, lipid disorders, metabolic syndrome and diseases and conditions that are mediated by excessive glucocorticoid action ABBVIE INC. 2006-07-06 US disclosed
CN-1147481-C Pyrimidine-2,4,6-triones as inhibitors of matrix metalloproteinases - 2004-04-28 CN disclosed
CN-1339028-A Pyrimidine-2,4,6-triones as inhibitors of matrix metalloproteinases HOFFMANN LA ROCHE (CH) 2002-03-06 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070179186-A1 for the treatment of non-insulin dependent type 2 diabetes, insulin resistance, obesity, lipid disorders, metabolic syndrome and conditions because of excessive glucocorticoid action; E-4-(2-methyl-2-phenoxy-propionylamino)-adamantane-1-carboxylic acid amide HSD17B1, HSD3B1, HSD17B2 SRD5A2 13/4885CYP4F2 443/4885CYP4A11 101/4885
US-20230058545-A1 HCK AS A THERAPEUTIC TARGET IN MYD88 MUTATED DISEASES HCK, LYN, BTK SRD5A2 3776/4885CYP4F2 1874/4885CYP4A11 1607/4885
US-10662174-B2 BTK inhibitor BTK, SYK, LYN SRD5A2 4036/4885CYP4F2 1729/4885CYP4A11 802/4885
US-20060149070-A1 Compounds such as E-4-{[1-(4-Chloro-phenyl)-cyclobutanecarbonyl]-amino}-adamantane-1-carboxylic acid, for therapy of non-insulin dependent type 2 diabetes, insulin resistance, obesity, lipid disorders, metabolic syndrome and diseases and conditions that are mediated by excessive glucocorticoid action HSD17B1, HSD11B1, HSD3B1 SRD5A2 17/4885CYP4F2 534/4885CYP4A11 68/4885
US-20090176783-A1 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME HSD11B1, HSD11B2, HSD17B1 SRD5A2 18/4885CYP4F2 286/4885CYP4A11 67/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.