SCHEMBL4802583

SCHEMBL4802583

[CH2]CNC1CCS(=O)(=O)C1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
GAA P10253 2/20 0.43
MITF O75030 1/20 0.42
LMNA P02545 2/20 0.41
HTT P42858 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.37

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
SCHEMBL11199747 0.82 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1MAPTGAAMITF
SCHEMBL11200026 0.82 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1MAPTGAAMITF
SCHEMBL2104647 0.81
SCHEMBL469045 0.78 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1MAPTGAALMNA
SCHEMBL12409575 0.78 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1MAPTGAALMNA
SCHEMBL11817502 0.78 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1MAPTGAAMITF
SCHEMBL11812131 0.78 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1MAPTGAAMITF
SCHEMBL5111267 0.78 MITF (0.50) SMN1; SMN2ALDH1A1MAPTGAAMITF
Hydrochloric Acid SCHEMBL11200108 0.77 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1MAPTGAAMITF
Hydrochloric Acid SCHEMBL21879630 0.77 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1MAPTGAALMNA

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-7427616-B2 Condensed pyridines and pyrimidines with tie2 (TEK) activity ASTRAZENECA AB (SE) 2008-09-23 US disclosed
EP-1537112-B1 CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY ASTRAZENECA AB (SE) 2006-04-19 EP disclosed
US-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity ASTRAZENECA AB (SE) 2005-11-17 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-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity TIE1, TEK, KDR SMN1; SMN2 2527/4885ALDH1A1 2177/4885MAPT 3034/4885

“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.