SCHEMBL1033337

SCHEMBL1033337

O=C(Cl)OC1C2CC3CC(C2)CC1C3

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.52
EPHX1 P07099 1/20 0.48
EPHX2 P34913 1/20 0.40
CYP2C9 P11712 2/20 0.38
FKBP1A P62942 1/20 0.36
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7927543 0.81 HSD11B1 (0.48) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL5350579 0.80 HSD11B1 (0.52) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL3753073 0.78 HSD11B1 (0.50) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL1155595 0.78 HSD11B1 (0.50) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL6670021 0.78 HSD11B1 (0.50) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL21392343 0.78 HSD11B1 (0.46) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL7927539 0.78 HSD11B1 (0.46) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL3905357 0.78 HSD11B1 (0.46) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL24361096 0.76 HSD11B1 (0.48) HSD11B1EPHX1EPHX2CYP2C9FKBP1A
SCHEMBL9016086 0.76 HSD11B1 (0.40) HSD11B1EPHX1EPHX2CYP2C9HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110627832-A Preparation method for synthesizing tenofovir alafenamide by oxidation method 江西农业大学 2019-12-31 CN claimed
CN-110627832-A Preparation method for synthesizing tenofovir alafenamide by oxidation method 江西农业大学 2019-12-31 CN disclosed
US-20190047939-A1 PROCESS AND INTERMEDIATES FOR THE PRODUCTION OF 17(20)-ENE B-SECO STEROIDS PATHEON AUSTRIA GMBH & CO KG (AU) 2019-02-14 US disclosed
CN-109219612-A Prepare 17 (20)-alkene B- open loop steroids method and intermediate 帕西昂奥地利有限两合公司 2019-01-15 CN disclosed
EP-3423465-A1 PROCESS AND INTERMEDIATES FOR THE PRODUCTION OF 17(20)-ENE B-SECO STEROIDS Patheon Austria GmbH & Co KG (AT) 2019-01-09 EP disclosed
US-9163012-B2 Carbamate and urea inhibitors of 11β-hydroxysteroid dehydrogenase 1 VITAE PHARMACEUTICALS, INC. (US) 2015-10-20 US disclosed
US-9163012-B2 Carbamate and urea inhibitors of 11β-hydroxysteroid dehydrogenase 1 VITAE PHARMACEUTICALS, INC. (US) 2015-10-20 US disclosed
US-9163012-B2 Carbamate and urea inhibitors of 11β-hydroxysteroid dehydrogenase 1 VITAE PHARMACEUTICALS, INC. (US) 2015-10-20 US disclosed
US-8927715-B2 Inhibitors of 11β-hydroxysteroid dehydrogenase type 1 VITAE PHARMACEUTICALS, INC. (US) 2015-01-06 US disclosed
US-8927715-B2 Inhibitors of 11β-hydroxysteroid dehydrogenase type 1 VITAE PHARMACEUTICALS, INC. (US) 2015-01-06 US disclosed
WO-1991019733-A1 DERIVATIVES OF TETRAPEPTIDES AS CCK AGONISTS ABBOTT LABORATORIES (US) 1991-12-26 WO disclosed
WO-1991000274-A1 N-SUBSTITUTED CYCLOALKYL AND POLYCYCLOALKYL ALPHA-SUBSTITUTED TRP-PHE- AND PHENETHYLAMINE DERIVATIVES WARNER-LAMBERT COMPANY (US) 1991-01-10 WO disclosed
EP-0405537-A1 N-substituted cycloalkyl and polycycloalkyl alpha-substituted Trp-Phe- and phenethylamine derivatives WARNER-LAMBERT COMPANY (US) 1991-01-02 EP disclosed
US-4591583-A TREATING VIRAL INFECTIONS ASTRA LAKEMEDEL AKTIEBOLAG (SE) 1986-05-27 US disclosed
US-4501741-A BENZOTHIOPHENE-SUBSTITUTED ELI LILLY AND COMPANY (US) 1985-02-26 US disclosed
EP-0122158-A2 Improvements in or relating to benzothienyl cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1984-10-17 EP disclosed
US-4386081-A VIRICIDE ASTRA LAKEMEDEL AKTIEBOLAG (SE) 1983-05-31 US disclosed
EP-0003007-B1 ALIPHATIC DERIVATIVES OF PHOSPHONOFORMIC ACID, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR COMBATING VIRUS INFECTIONS Astra Läkemedel Aktiebolag (SE) 1982-04-07 EP disclosed
EP-0003007-A2 Aliphatic derivatives of phosphonoformic acid, pharmaceutical compositions and methods for combating virus infections Astra Läkemedel Aktiebolag (SE) 1979-07-11 EP disclosed
US-3936491-A Adamantylene compounds U.S. PHILIPS CORPORATION (US) 1976-02-03 US 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 (1 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-20190047939-A1 PROCESS AND INTERMEDIATES FOR THE PRODUCTION OF 17(20)-ENE B-SECO STEROIDS CYP17A1, CYP46A1, HSD17B7 HSD11B1 7/4885EPHX1 144/4885EPHX2 201/4885

“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.