SCHEMBL10148691

SCHEMBL10148691

Cc1ncnn2c([C@]3(C#N)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@@]3(C)F)ccc12

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.38
▸ P2RY2 P41231 10/20 0.37
▸ P2RY4 P51582 1/20 0.37
▸ P2RX1 P51575 1/20 0.36
▸ P2RX3 P56373 1/20 0.36
▸ P2RX4 Q99571 1/20 0.36
▸ POLA1 P09884 1/20 0.35

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
SCHEMBL17124608 0.92 POLRMT (0.38) POLRMTP2RY2P2RY4P2RX1P2RX3
SCHEMBL12393421 0.92 P2RY2 (0.39) POLRMTP2RY2P2RY4P2RX1P2RX3
SCHEMBL10148632 0.92 TMPRSS2 (0.34) —
Gs-441326 SCHEMBL10149536 0.91 POLRMT (0.47) POLRMTP2RX1P2RX3P2RX4
SCHEMBL12397122 0.89 P2RX3 (0.36) POLRMTP2RY2P2RY4P2RX1P2RX3
SCHEMBL12464640 0.84 POLRMT (0.45) POLRMTP2RX1P2RX3P2RX4
SCHEMBL10142499 0.83 POLRMT (0.47) POLRMTP2RY2P2RY4P2RX1P2RX3
SCHEMBL17129823 0.83 POLRMT (0.47) POLRMTP2RX1P2RX3P2RX4
SCHEMBL17129838 0.83 POLRMT (0.47) POLRMTP2RX1P2RX3P2RX4
SCHEMBL12393465 0.83 TMPRSS2 (0.35) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455451-B2 2'-fluoro substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2013-06-04 — — US disclosed
US-20120009147-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-01-12 — — US disclosed
US-20110070194-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2011-03-24 — — 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 (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-20120009147-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, NSUN2, CDA POLRMT 281/4885P2RY2 309/4885P2RY4 206/4885
US-20110070194-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, RNGTT, SLC29A1 POLRMT 188/4885P2RY2 271/4885P2RY4 165/4885

“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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