SCHEMBL18349643

SCHEMBL18349643

O=C(NCCCCOC(=O)N1C[C@H](O)C[C@H]1CO)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
ABCB1 P08183 1/20 0.47
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TGM2 P21980 1/20 0.46
DPP8 Q6V1X1 4/20 0.46
DPP7 Q9UHL4 4/20 0.46
POLB P06746 1/20 0.45
KEAP1 Q14145 3/20 0.44
NFE2L2 Q16236 3/20 0.44
DPP4 P27487 3/20 0.44
DPP9 Q86TI2 2/20 0.44
TLR2 O60603 1/20 0.44
TLR1 Q15399 1/20 0.44
FOLH1 Q04609 3/20 0.43
PREP P48147 2/20 0.42

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
SCHEMBL16281706 0.86 PREP (0.54) HTTABCB1LMNASMN1; SMN2TGM2
SCHEMBL3426821 0.86 PREP (0.54) HTTABCB1LMNASMN1; SMN2TGM2
SCHEMBL13032648 0.86 PREP (0.54) HTTABCB1LMNASMN1; SMN2TGM2
SCHEMBL3578965 0.84 POLB (0.55) SMN1; SMN2POLBPREP
SCHEMBL8660402 0.84 POLB (0.55) SMN1; SMN2POLBPREP
SCHEMBL14012812 0.84 POLB (0.55) SMN1; SMN2POLBPREP
SCHEMBL8697857 0.84 POLB (0.55) SMN1; SMN2POLBPREP
SCHEMBL9586427 0.84 POLB (0.55) SMN1; SMN2POLBPREP
SCHEMBL12164616 0.84 POLB (0.55) SMN1; SMN2POLBPREP
SCHEMBL13032587 0.83 GAA (0.52) HTTLMNASMN1; SMN2TGM2DPP8

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-20160376585-A1 OLIGONUCLEOTIDE-LIGAND CONJUGATES AND PROCESS FOR THEIR PREPARATION BANK OF AMERICA, N.A. 2016-12-29 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-20160376585-A1 OLIGONUCLEOTIDE-LIGAND CONJUGATES AND PROCESS FOR THEIR PREPARATION IGF2R, IRS1, INSR HTT 1374/4885ABCB1 2830/4885LMNA 587/4885

“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.