SCHEMBL12261202

SCHEMBL12261202

COC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](c2scc3c(=O)[nH]c(N)nc23)[C@](C)(O)[C@@H]1O)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ BTN3A1 O00481 5/20 0.37
▸ HINT1 P49773 1/20 0.37
▸ TYMS P04818 2/20 0.32
▸ TAS1R3 Q7RTX0 1/20 0.31
▸ TAS1R1 Q7RTX1 1/20 0.31
▸ EIF4E P06730 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
SCHEMBL12261240 0.89 CYP3A4 (0.38) CYP3A4CYP2C9BTN3A1HINT1
SCHEMBL12261217 0.89 CYP3A4 (0.38) CYP3A4CYP2C9HINT1EIF4E
SCHEMBL12261205 0.88 CYP3A4 (0.44) CYP3A4CYP2C9BTN3A1HINT1EIF4E
SCHEMBL12260844 0.81 CYP3A4 (0.41) CYP3A4CYP2C9BTN3A1
SCHEMBL14393214 0.81 CYP3A4 (0.54) CYP3A4CYP2C9BTN3A1HINT1TYMS
SCHEMBL14367303 0.81 CYP3A4 (0.54) CYP3A4CYP2C9BTN3A1HINT1TYMS
SCHEMBL12261233 0.79 HPRT1 (0.41) HINT1TAS1R3TAS1R1EIF4E
SCHEMBL12253923 0.79 CYP3A4 (0.46) CYP3A4CYP2C9BTN3A1HINT1TYMS
SCHEMBL12651147 0.79 CYP3A4 (0.51) CYP3A4CYP2C9HINT1TAS1R3TAS1R1
SCHEMBL14216817 0.79 CYP3A4 (0.51) CYP3A4CYP2C9HINT1TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8012942-B2 Carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-09-06 — — US disclosed
US-8012942-B2 Carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-09-06 — — US disclosed
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-12 — — US disclosed
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-12 — — 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-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, TYMP, MTAP CYP3A4 1378/4885CYP2C9 2679/4885BTN3A1 2686/4885

“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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