SCHEMBL19500413

SCHEMBL19500413

CC(=O)NC1C(OCCCCC(=O)OCc2ccccc2)OC(COC(C)=O)C(C)C1C

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.49
KMT2A Q03164 1/20 0.49
POLB P06746 2/20 0.46
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 3/20 0.38
LGALS8 O00214 1/20 0.36
MCHR1 Q99705 2/20 0.36
SSTR2 P30874 2/20 0.36
SSTR3 P32745 2/20 0.36
SSTR5 P35346 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP2D6 P10635 1/20 0.35

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
SCHEMBL18073843 0.91 LMNA (0.57) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL9604424 0.89 ALDH1A1 (0.42) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL16248647 0.89 ALDH1A1 (0.42) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL17589419 0.88 ALDH1A1 (0.41) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL17860904 0.88 LMNA (0.67) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL16217771 0.88 LMNA (0.67) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL17448301 0.88 LMNA (0.67) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL20828068 0.88 LMNA (0.67) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL23069355 0.87 LMNA (0.66) LMNAKMT2APOLBCYP3A4MAPT
SCHEMBL31400149 0.87 LMNA (0.66) LMNAKMT2APOLBCYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170305956-A1 Ligand-Modified Double-Stranded Nucleic Acids NOVO NORDISK A/S (DK) 2017-10-26 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-20170305956-A1 Ligand-Modified Double-Stranded Nucleic Acids ADAR, NCL, SSU72 LMNA 528/4885KMT2A 2367/4885POLB 177/4885

“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.