Tetrahydrofuran

Tetrahydrofuran

SCHEMBL130819

C1CCOC1.C1CCOC1.Clc1ncnc2[nH]cnc12

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 2/20 0.34
▸ PDPK1 O15530 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ PAK1 Q13153 1/20 0.33
▸ LRRK2 Q5S007 4/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ STK4 Q13043 1/20 0.30
▸ STK3 Q13188 1/20 0.30

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
SCHEMBL30942632 0.86 CHEK1 (0.42) CHEK1LRRK2JAK3
SCHEMBL8716026 0.84 CHEK1 (0.41) CHEK1LRRK2JAK3
SCHEMBL9798919 0.84 CHEK1 (0.41) CHEK1LRRK2JAK3
Adenine SCHEMBL28195376 0.81 PI4KA (0.38) CHEK1PDPK1MAPK1PAK1LRRK2
Tetrahydrofuran SCHEMBL4865495 0.80 CHEK1 (0.33) CHEK1PDPK1MAPK1PAK1LRRK2
Trimethylammonium SCHEMBL8826193 0.79 CHEK1 (0.38) CHEK1PDPK1LRRK2STK4STK3
Acetone SCHEMBL3279080 0.76 CHEK1 (0.36) CHEK1
2-Pyrrolidone SCHEMBL9220735 0.74 OR51E2 (0.43) CHEK1
Purine SCHEMBL6959949 0.72 CHEK1 (0.33) CHEK1
Hypoxanthine SCHEMBL11439069 0.71 ALDH1A1 (0.56) CHEK1PDPK1LRRK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1467990-B1 PROCESS FOR PRODUCING DIOXOLANE NUCLEOSIDE ANALOGUE PRECURSORS SHIRE BIOCHEM INC (CA) 2012-03-07 — — EP disclosed
US-7442813-B2 Process for producing dioxolane nucleoside analogues SHIRE BIOCHEM INC. (CA) 2008-10-28 — — US disclosed
US-20070197784-A1 Process for producing dioxolane nucleoside analogues TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-08-23 — — US disclosed
US-20050085638-A1 Process for producing dioxolane nucleoside analogues SHIRE BIOCHEM INC (CA) 2005-04-21 — — US disclosed
EP-1467990-A1 PROCESS FOR PRODUCING DIOXOLANE NUCLEOSIDE ANALOGUES Shire Biochem Inc. (CA) 2004-10-20 — — EP disclosed
WO-2003062229-A1 PROCESS FOR PRODUCING DIOXOLANE NUCLEOSIDE ANALOGUES SHIRE BIOCHEM INC. (CA) 2003-07-31 — — 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-20050085638-A1 Process for producing dioxolane nucleoside analogues NUDT1, DPYD, DUT CHEK1 2207/4885PDPK1 648/4885MAPK1 902/4885
US-20070197784-A1 Process for producing dioxolane nucleoside analogues NUDT1, DPYD, DUT CHEK1 2207/4885PDPK1 648/4885MAPK1 902/4885

“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.

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