SCHEMBL14946306

SCHEMBL14946306

CCC1(CC)O[C@@H](n2cc(C)c(=O)[nH]c2=O)C(OC(C)=O)[C@H]1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.44
RNASE1 P07998 1/20 0.40
HPGD P15428 1/20 0.39
TK2 O00142 2/20 0.39
BCHE P06276 2/20 0.38
NT5M Q9NPB1 1/20 0.38
TYMP P19971 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
ALB P02768 1/20 0.36
POLB P06746 1/20 0.36
ADRA1A P35348 1/20 0.36
BLM P54132 1/20 0.36

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
SCHEMBL11981102 1.00 TK1 (0.44) TK1RNASE1HPGDTK2BCHE
SCHEMBL11981123 0.95 TK1 (0.42) TK1RNASE1HPGDTK2BCHE
SCHEMBL23152977 0.94 TK1 (0.41) TK1RNASE1HPGDTK2BCHE
SCHEMBL9961264 0.91 TK1 (0.37) TK1RNASE1HPGDBCHENT5M
SCHEMBL17282465 0.90 TK1 (0.39) TK1RNASE1HPGDTK2BCHE
SCHEMBL17356765 0.89 TK1 (0.41) TK1RNASE1HPGDTK2BCHE
SCHEMBL17282463 0.89 TK1 (0.38) TK1RNASE1HPGDTK2BCHE
SCHEMBL2767915 0.88 RNASE1 (0.44) TK1RNASE1HPGDTK2BCHE
SCHEMBL5696121 0.88 TK1 (0.39) TK1RNASE1HPGDTK2BCHE
SCHEMBL28618584 0.88 TK1 (0.39) TK1RNASE1HPGDTK2BCHE

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-9127280-B2 Oligonucleotide, and therapeutic agent for dyslipidemia containing oligonucleotide as active ingredient OSAKA UNIVERSITY (JP) 2015-09-08 US disclosed
US-20130172402-A1 OLIGONUCLEOTIDE, AND THERAPEUTIC AGENT FOR DYSLIPIDEMIA CONTAINING OLIGONUCLEOTIDE AS ACTIVE INGREDIENT OSAKA UNIVERSITY (JP) 2013-07-04 US disclosed
US-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF modeRNA Therapeutics (US) 2013-05-16 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 (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-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 TK1 198/4885RNASE1 77/4885HPGD 2978/4885

“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.