SCHEMBL708628

SCHEMBL708628

CC(C)(C)OC(=O)N1CC(OCc2ccccc2)CC1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.52
AGTR2 P50052 6/20 0.52
KLK7 P49862 1/20 0.48
MCL1 Q07820 5/20 0.45
UCHL1 P09936 1/20 0.44
BDKRB2 P30411 2/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43

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
SCHEMBL376159 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL3179881 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL708630 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL708629 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL7287734 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL1448119 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL949983 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL26604823 1.00 ABCB1 (0.52) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL13164545 0.95 ABCB1 (0.47) ABCB1AGTR2KLK7MCL1UCHL1
SCHEMBL29548192 0.93 MCL1 (0.50) ABCB1AGTR2KLK7MCL1UCHL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365599-A1 Arginase Inhibitors and Methods of Use Thereof ASTRAZENECA AB (SE) 2023-11-16 US disclosed
CN-116096714-A Antiviral compounds for the treatment of coronavirus, picornavirus and norovirus infections 安力高医药股份有限公司 2023-05-09 CN disclosed
US-9468693-B2 Labeled molecular imaging agents and methods of use GENERAL ELECTRIC COMPANY (US) 2016-10-18 US disclosed
US-9468693-B2 Labeled molecular imaging agents and methods of use GENERAL ELECTRIC COMPANY (US) 2016-10-18 US disclosed
EP-2931727-A1 DIAZEPINE DERIVATIVES USEFUL AS CALCIUM CHANNEL BLOCKERS IN THE TREATMENT OF PAIN Abbvie Inc. (US) 2015-10-21 EP disclosed
WO-2015112333-A1 LABELED MOLECULAR AGENTS FOR IMAGING CYSTINE/GLUTAMATE ANTI PORTER GENERAL ELECTRIC COMPANY (US) 2015-07-30 WO disclosed
US-20150202333-A1 LABELED MOLECULAR IMAGING AGENTS AND METHODS OF USE GENERAL ELECTRIC COMPANY (US) 2015-07-23 US disclosed
US-20150202333-A1 LABELED MOLECULAR IMAGING AGENTS AND METHODS OF USE GENERAL ELECTRIC COMPANY (US) 2015-07-23 US disclosed
WO-2014093337-A1 DIAZEPINE DERIVATIVES USEFUL AS CALCIUM CHANNEL BLOCKERS IN THE TREATMENT OF PAIN ABBVIE, INC. (US) 2014-06-19 WO disclosed
EP-2280970-B1 IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN LA ROCHE (CH) 2014-01-08 EP disclosed
EP-0833633-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1999-03-24 EP disclosed
US-5847135-A Inhibitors of interleukin-1β converting enzyme VERTEX PHARMACEUTICALS, INCORPORATED (US) 1998-12-08 US disclosed
US-5756466-A Inhibitors of interleukin-1β converting enzyme VERTEX PHARMACEUTICALS, INC. (US) 1998-05-26 US disclosed
US-5756528-A ANTICARCINOGENIC AGENTS MERCK & CO., INC. (US) 1998-05-26 US disclosed
EP-0833633-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-04-08 EP disclosed
US-5716929-A THERAPY FOR INFLAMMATION, AUTOIMMUNE DISEASES VERTEX PHARMACEUTICALS, INC. (US) 1998-02-10 US disclosed
US-5656627-A USEFUL IN TREATING INFLAMMATORY, AUTOIMMUNE AND NEURODEGENERATIVE DISEASES VERTEX PHARMACEUTICALS, INC. (US) 1997-08-12 US disclosed
EP-0784628-A1 INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME Vertex Pharmaceuticals Incorporated (US) 1997-07-23 EP disclosed
WO-1996039137-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-12-12 WO disclosed
WO-1995035308-A1 INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME VERTEX PHARMACEUTICALS INCORPORATED (US) 1995-12-28 WO 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 (2 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-20230365599-A1 Arginase Inhibitors and Methods of Use Thereof ARG1, ARG2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ABCB1 870/4885AGTR2 119/4885KLK7 4255/4885
US-20150202333-A1 LABELED MOLECULAR IMAGING AGENTS AND METHODS OF USE SLC7A11, GLS, SLC3A2 ABCB1 823/4885AGTR2 1078/4885KLK7 3009/4885

“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.