SCHEMBL4088736

SCHEMBL4088736

C#CC1(O)COC(C)(C)OC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
KCNA4 P22459 1/20 0.31
KCNA1 Q09470 1/20 0.31
KCNAB1 Q14722 1/20 0.31

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
SCHEMBL19788879 0.73 KCNA4 (0.30) KCNA4KCNA1KCNAB1
SCHEMBL11971096 0.73
SCHEMBL17761458 0.71 KCNA4 (0.33) KCNA4KCNA1KCNAB1
SCHEMBL2894816 0.71
SCHEMBL28149512 0.69 KCNA4 (0.37) KCNA4KCNA1KCNAB1
SCHEMBL1487068 0.69 KCNA4 (0.37) KCNA4KCNA1KCNAB1
SCHEMBL17616467 0.69
SCHEMBL16468822 0.65 ALDH1A1 (0.34) ALDH1A1
SCHEMBL17616534 0.63 ALDH1A1 (0.52) ALDH1A1
SCHEMBL15199621 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3186239-B1 ANTIRETROVIRAL AGENTS GILEAD SCIENCES INC (US) 2018-10-10 EP disclosed
US-9873680-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2018-01-23 US disclosed
WO-2016033243-A9 ANTIRETROVIRAL AGENTS GILEAD SCIENCES, INC. (US) 2016-05-19 WO disclosed
US-20160083368-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-03-24 US disclosed
WO-2009054887-A1 PROCESS FOR PREPARING AN ANTI-HYPERCHOLESTEROLEMIC COMPOUND MERCK & CO., INC. (US) 2009-04-30 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 (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-20160083368-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, G6PD ALDH1A1 372/4885KCNA4 3804/4885KCNA1 3537/4885

“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.