SCHEMBL10083240

SCHEMBL10083240

Cc1cn([C@H]2CC[C@](CO)(C(F)(F)F)O2)c(=O)[nH]c1=O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TK1 P04183 10/20 0.47
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
ALB P02768 1/20 0.44
POLB P06746 1/20 0.44
ADRA1A P35348 1/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL23622010 0.82 TK1 (0.49) TK1ALDH1A1LMNAALBPOLB
SCHEMBL9548652 0.82 TK1 (0.51) TK1ALDH1A1LMNAALBPOLB
SCHEMBL24695053 0.81 TK1 (0.50) TK1ALDH1A1LMNAALBPOLB
SCHEMBL7543825 0.80 TK1 (0.46) TK1ALDH1A1LMNAALBPOLB
SCHEMBL9151709 0.78 TK1 (0.49) TK1ALDH1A1LMNAALBPOLB
SCHEMBL20833453 0.78 TK1 (0.47) TK1ALDH1A1LMNAALBPOLB
SCHEMBL20879499 0.78 TK1 (0.47) TK1ALDH1A1LMNAALBPOLB
SCHEMBL9151712 0.78 TK1 (0.49) TK1ALDH1A1LMNAALBPOLB
SCHEMBL10083620 0.78 ALB (0.38) ALB
SCHEMBL20833146 0.77 TK1 (0.47) TK1ALDH1A1LMNAALBPOLB

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-20120034184-A1 4'-SUBSTITUTED NUCLEOSIDE DERIVATIVES AS INHIBITORS OF HCV RNA REPLICATION DEVOS RENE ROBERT (GB) 2012-02-09 US disclosed
US-8071567-B2 4′-substituted nucleoside derivatives as inhibitors of HCV RNA replication ROCHE PALO ALTO LLC (US) 2011-12-06 US disclosed
US-20100003213-A1 4'-SUBSTITUTED NUCLEOSIDE DERIVATIVES AS INHIBITORS OF HCV RNA REPLICATION DEVOS RENE ROBERT 2010-01-07 US disclosed
US-7608601-B2 4′-Substituted nucleoside derivatives as inhibitors of HCV RNA replication ROCHE PALO ALTO LLC (US) 2009-10-27 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-20100003213-A1 4'-SUBSTITUTED NUCLEOSIDE DERIVATIVES AS INHIBITORS OF HCV RNA REPLICATION NSUN2, RNGTT, RNMT TK1 342/4885ALDH1A1 903/4885LMNA 3086/4885
US-20120034184-A1 4'-SUBSTITUTED NUCLEOSIDE DERIVATIVES AS INHIBITORS OF HCV RNA REPLICATION NSUN2, RNGTT, RNMT TK1 533/4885ALDH1A1 622/4885LMNA 2119/4885

“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.