SCHEMBL6358753

SCHEMBL6358753

Cc1cn([C@H]2CC(OCOCc3ccccc3)[C@@H](C(=O)O)O2)c(=O)n(COCc2ccccc2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.36
RNASE1 P07998 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TK2 O00142 1/20 0.31
PDE4D Q08499 2/20 0.31
ELANE P08246 1/20 0.31
S1PR1 P21453 1/20 0.30
S1PR5 Q9H228 1/20 0.30
APP P05067 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6363668 0.88 RNASE1 (0.45) TK1RNASE1TK2PDE4D
SCHEMBL6362720 0.81 TOP2A (0.34) TK1RNASE1TK2
SCHEMBL9396525 0.80 RNASE1 (0.50) TK1RNASE1ALDH1A1
SCHEMBL7975895 0.80 RNASE1 (0.50) TK1RNASE1TK2PDE4D
SCHEMBL7788368 0.78 PDE4D (0.45) TK1RNASE1TK2PDE4DLMNA
SCHEMBL6358756 0.76 ALDH1A1 (0.34) TK1ALDH1A1S1PR1S1PR5SMN1; SMN2
SCHEMBL9702755 0.73 RNASE1 (0.48) TK1RNASE1TK2PDE4D
SCHEMBL9396372 0.73 RNASE1 (0.42) RNASE1
SCHEMBL31286197 0.73 DHFR (0.39) TK1RNASE1ALDH1A1TK2
SCHEMBL13415582 0.72 CTSV (0.39) TK1RNASE1ALDH1A1

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
US-6900297-B1 Amine-derivatized nucleosides and oligonucleosides ISIS PHARMACEUTICALS, INC. (US) 2005-05-31 US disclosed
EP-1487855-A2 METHOD OF USING MODIFIED OLIGONUCLEOTIDES FOR HEPATIC DELIVERY ISIS Pharmaceuticals, Inc. (US) 2004-12-22 EP disclosed
US-20040142899-A1 Compositions and methods for enhanced biostability and altered biodistribution of oligonucleotides in mammals ISIS PHARMACEUTICALS, INC. (US) 2004-07-22 US disclosed
US-6753423-B1 FOR PREFERENTIALLY MODULATED GENE EXPRESSION IN LIVER AND ASSOCIATED TISSUES ISIS PHARMACEUTICALS, INC. 2004-06-22 US disclosed
US-20030191075-A1 Method of using modified oligonucleotides for hepatic delivery ISIS PHARMACEUTICALS, INC. 2003-10-09 US disclosed
WO-2003072711-A2 METHOD OF USING MODIFIED OLIGONUCLEOTIDES FOR HEPATIC DELIVERY ISIS PHARMACEUTICALS, INC. (US) 2003-09-04 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 (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-20040142899-A1 Compositions and methods for enhanced biostability and altered biodistribution of oligonucleotides in mammals FABP1, RNASE1, RNGTT TK1 38/4885RNASE1 2/4885ALDH1A1 1651/4885
US-20030191075-A1 Method of using modified oligonucleotides for hepatic delivery FABP1, DCLRE1B, SLC10A1 TK1 105/4885RNASE1 8/4885ALDH1A1 2822/4885

“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.