SCHEMBL13396012

SCHEMBL13396012

Cc1cn(C2CC(OCc3ccccc3)C(C(C)C)O2)c(=O)n(Cc2ccccc2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSV O60911 1/20 0.38
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
CTSC P53634 1/20 0.38
CTSF Q9UBX1 1/20 0.38
TK1 P04183 3/20 0.37
KMT2A Q03164 2/20 0.37
BRD4 O60885 3/20 0.37
HSP90AA1 P07900 1/20 0.36
MEN1 O00255 1/20 0.35
RNASE1 P07998 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ATM Q13315 1/20 0.34
C5AR1 P21730 1/20 0.34
TK2 O00142 1/20 0.34

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
SCHEMBL13415582 0.89 CTSV (0.39) CTSVCTSLCTSBCTSSCTSK
SCHEMBL9702755 0.87 RNASE1 (0.48) CTSVCTSLCTSBCTSSCTSK
SCHEMBL26233704 0.76 CA12 (0.36) TK1KMT2AMEN1RNASE1ALDH1A1
SCHEMBL26233706 0.75 RNASE1 (0.41) TK1RNASE1TK2
SCHEMBL26233701 0.75 TK1 (0.43) TK1
SCHEMBL26233698 0.74 TOP2A (0.37) TK1KMT2ABRD4MEN1RNASE1
SCHEMBL21564054 0.74 TK1 (0.44) TK1RNASE1TK2
SCHEMBL2056807 0.74 TK1 (0.44) TK1RNASE1TK2
SCHEMBL21545828 0.73 TOP2A (0.44) TK1RNASE1TK2
SCHEMBL21564055 0.73 TOP2A (0.44) TK1RNASE1TK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 US disclosed
US-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 US disclosed
US-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-04-29 US disclosed
US-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-04-29 US disclosed
WO-2008100447-A2 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2008-08-21 WO 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-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT SLC29A1, NUDT1, EIF2AK2 CTSV 3093/4885CTSL 4159/4885CTSB 3888/4885

“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.