SCHEMBL10359587

SCHEMBL10359587

CCC(C)(C)OC(=O)n1ccnc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 9/20 0.36
CYP24A1 Q07973 2/20 0.35
AHR P35869 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP17A1 P05093 1/20 0.33
GPR119 Q8TDV5 1/20 0.32
LMNA P02545 1/20 0.32
EGLN3 Q9H6Z9 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
SCHEMBL1199386 0.87 AHR (0.36) TBXAS1CYP24A1AHRALDH1A1CYP17A1
SCHEMBL29247460 0.85 CYP24A1 (0.35) TBXAS1CYP24A1AHRALDH1A1GPR119
SCHEMBL17026721 0.84 TBXAS1 (0.37) TBXAS1CYP24A1AHR
SCHEMBL13479037 0.84 TBXAS1 (0.35) TBXAS1CYP24A1ALDH1A1GPR119
SCHEMBL217823 0.82 GPR119 (0.42) TBXAS1CYP24A1CYP17A1GPR119
SCHEMBL6094444 0.81 CYP24A1 (0.33) TBXAS1CYP24A1ALDH1A1GPR119
SCHEMBL16391056 0.79 CYP24A1 (0.32) TBXAS1CYP24A1
SCHEMBL26596807 0.79 TBXAS1 (0.35) TBXAS1CYP24A1ALDH1A1GPR119LMNA
SCHEMBL23604883 0.78 AHR (0.31) TBXAS1CYP24A1AHR
SCHEMBL19152231 0.77 CYP24A1 (0.35) TBXAS1CYP24A1ALDH1A1LMNA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11799133-B2 Non-aqueous electrolyte solution for lithium secondary battery and lithium secondary battery including the same LG ENERGY SOLUTION, LTD. 2023-10-24 US disclosed
US-11780844-B2 Compounds and methods for treatment of viral infections GILEAD SCIENCES, INC. (US) 2023-10-10 US disclosed
US-20230279015-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
US-20230279015-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
US-20230279013-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
US-20230279014-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
US-20230279014-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
WO-2023055920-A1 MODULATORS OF TRPML, THEIR COMPOSITIONS AND METHODS OF USE CARAWAY THERAPEUTICS, INC. (US) 2023-04-06 WO disclosed
EP-0236888-B1 PROCESS FOR BLOCKING AMINO ACIDS WITH THE TERTIARY-ALKOXY-CARBONYL GROUP PPG INDUSTRIES, INC. (US) 1990-11-14 EP disclosed
US-4837332-A REACTING AMINE SALT OF AMINO ACID WITH TERTIARY ALKOXYCARBONYLIMIDAZOLE IN SPECIFIC INERT SOLVENT PPG INDUSTRIES, INC. (US) 1989-06-06 US disclosed
EP-0236888-A1 Process for blocking amino acids with the tertiary-alkoxy-carbonyl group PPG INDUSTRIES, INC. (US) 1987-09-16 EP 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-11780844-B2 Compounds and methods for treatment of viral infections HAVCR2, EIF2AK2, OAT TBXAS1 1151/4885CYP24A1 1821/4885AHR 3343/4885
US-20230279015-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT TBXAS1 1151/4885CYP24A1 1821/4885AHR 3343/4885
US-20230279014-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT TBXAS1 1151/4885CYP24A1 1821/4885AHR 3343/4885
US-20230279013-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT TBXAS1 1151/4885CYP24A1 1821/4885AHR 3343/4885
US-11799133-B2 Non-aqueous electrolyte solution for lithium secondary battery and lithium secondary battery including the same CACNA1S, PDHB, CACNA1F TBXAS1 4114/4885CYP24A1 1038/4885AHR 4284/4885

“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.