SCHEMBL12552199

SCHEMBL12552199

O=C1NCCNC1CCCS

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 2/20 0.37
GLA P06280 1/20 0.37
USP2 O75604 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 2/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL12552289 0.88 LMNA (0.39) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL12552290 0.83
SCHEMBL13447330 0.81 SMN1; SMN2 (0.41) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL12552202 0.81 LMNA (0.40) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL559663 0.79 SMN1; SMN2 (0.40) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL1385291 0.76 SMN1; SMN2 (0.43) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL1385293 0.76 SMN1; SMN2 (0.43) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL12552235 0.76 LMNA (0.42) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL10842286 0.72 HDAC8 (0.57) LMNASMN1; SMN2TSHRGLAUSP2
SCHEMBL13412492 0.72 LMNA (0.42) LMNASMN1; SMN2TSHRGLAUSP2

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-20150112051-A1 CONSTRUCTION OF CELL PENETRATING NUCLEIC ACIDS Panzner, Steffen 2015-04-23 US disclosed
US-8957191-B2 Nucleic acid comprising zwitterionic nucleotides STEFFEN PANZNER (DE) 2015-02-17 US disclosed
US-20110137019-A1 NUCLEIC ACID COMPRISING ZWITTERIONIC NUCLEOTIDES BIONTECH PROTEIN THERAPEUTICS GMBH (DE) 2011-06-09 US disclosed
WO-2010004054-A2 CONSTRUCTION OF CELL PENETRATING NUCLEIC ACIDS NOVOSOM AG (DE) 2010-01-14 WO disclosed
EP-2143726-A1 Nucleic acid comprising zwitterionic nucleotides Novosom AG (DE) 2010-01-13 EP 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-20110137019-A1 NUCLEIC ACID COMPRISING ZWITTERIONIC NUCLEOTIDES NSUN3, NCL, NUDT1 LMNA 271/4885SMN1; SMN2 4195/4885TSHR 1458/4885

“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.