SCHEMBL10183545

SCHEMBL10183545

C[C@@]1(F)[C@H](O)[C@@H](COP(=O)(O)NCCc2c[nH]c3ccccc23)O[C@@]1(C#N)c1ccc2c(N)ncnn12

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DCPS Q96C86 3/20 0.41
▸ MAPT P10636 1/20 0.34
▸ ABCC1 P33527 1/20 0.34
▸ INMT O95050 3/20 0.33
▸ HINT1 P49773 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
SCHEMBL10184151 0.92 DCPS (0.36) DCPSMAPTABCC1INMT
SCHEMBL14996130 0.92 DCPS (0.36) DCPSMAPTABCC1INMT
SCHEMBL10184144 0.88 DCPS (0.35) DCPSMAPTHINT1
SCHEMBL18214649 0.88 MAPT (0.33) DCPSMAPTABCC1INMTHINT1
SCHEMBL18214643 0.88 DCPS (0.34) DCPS
SCHEMBL18697875 0.85 DCPS (0.42) DCPSINMTHINT1
SCHEMBL12465037 0.83 DCPS (0.35) DCPSMAPTABCC1INMTHINT1
SCHEMBL10149707 0.81 POLRMT (0.38) —
SCHEMBL18697844 0.81 POLRMT (0.38) —
SCHEMBL10149577 0.81 MAPT (0.38) MAPT

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-3150608-A1 2' -FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT Gilead Sciences, Inc. (US) 2017-04-05 — — EP disclosed
EP-2480552-B1 2' -FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES INC (US) 2016-11-09 — — EP disclosed
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-7973013-B2 2'-fluoro substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-07-05 — — 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 DCPS 173/4885MAPT 4506/4885ABCC1 1088/4885
US-20110070194-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, RNGTT, SLC29A1 DCPS 248/4885MAPT 4330/4885ABCC1 1131/4885

“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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