SCHEMBL4765244

SCHEMBL4765244

CC[C@H]1O[C@@H](c2ccc3c(N)ncnn23)[C@H](F)[C@@H]1C

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.35
▸ MAP4K4 O95819 1/20 0.34
▸ DOT1L Q8TEK3 1/20 0.32
▸ TNIK Q9UKE5 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
SCHEMBL4765238 1.00 POLRMT (0.35) POLRMTMAP4K4DOT1LTNIK
SCHEMBL10101549 0.90 POLRMT (0.36) POLRMTMAP4K4DOT1LTNIK
SCHEMBL10101489 0.90 POLRMT (0.36) POLRMTMAP4K4DOT1LTNIK
SCHEMBL15257392 0.81 ADK (0.30) —
SCHEMBL17131346 0.81 POLRMT (0.41) POLRMTMAP4K4DOT1L
SCHEMBL4765542 0.81 — —
SCHEMBL4765508 0.81 — —
SCHEMBL16479516 0.79 POLRMT (0.40) POLRMTDOT1L
SCHEMBL806951 0.79 POLRMT (0.40) POLRMTDOT1L
SCHEMBL19101901 0.79 POLRMT (0.40) POLRMTDOT1L

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-20170226140-A1 2' FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2017-08-10 — — US disclosed
US-20140200188-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2014-07-17 — — US disclosed
US-20120107274-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-05-03 — — 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 (3 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-20140200188-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, NSUN2, SLC29A2 POLRMT 101/4885MAP4K4 1279/4885DOT1L 1296/4885
US-20170226140-A1 2' FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, NUDT1, NSUN2 POLRMT 103/4885MAP4K4 1486/4885DOT1L 1221/4885
US-20120107274-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, NUDT1, SLC29A2 POLRMT 103/4885MAP4K4 1289/4885DOT1L 1151/4885

“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.

Send feedback