SCHEMBL1809554

SCHEMBL1809554

O=C(O)CCCS(=O)(=O)C1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
LMNA P02545 4/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
EPHX2 P34913 1/20 0.39
APEX1 P27695 1/20 0.38
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
PMP22 Q01453 1/20 0.37
EPHX1 P07099 1/20 0.37
ALKBH5 Q6P6C2 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
CAMK2A Q9UQM7 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C9 P11712 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL9345595 0.86 ALDH1A1 (0.46) ALDH1A1LMNAEPHX2APEX1EPHX1
SCHEMBL777574 0.78 CA1 (0.33)
Succinic Acid SCHEMBL5704139 0.77 ALDH1A1 (0.48) ALDH1A1LMNAEPHX2APEX1EPHX1
SCHEMBL2951024 0.76 CA1 (0.32)
SCHEMBL8147652 0.75 EPHX1 (0.33) EPHX1
SCHEMBL8142928 0.73 APP (0.38) LMNA
SCHEMBL13954196 0.73
SCHEMBL6406451 0.72 POLB (0.40) ALDH1A1LMNAEPHX2EPHX1POLB
SCHEMBL20714713 0.72 MMP1 (0.38) ALDH1A1LMNASMN1; SMN2CYP1A2MAPK1
SCHEMBL23149821 0.71 CYP1A2 (0.41) ALDH1A1LMNAEPHX2EPHX1SMN1; SMN2

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
EP-1801108-B9 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2013-11-20 EP disclosed
EP-1801108-B1 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2012-11-14 EP disclosed
US-7935700-B2 Morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-03 US disclosed
US-20070265257-A1 Morpholine Compound MITSUBISHI PHARMA CORPORATION (JP) 2007-11-15 US disclosed
EP-1801108-A1 MORPHOLINE COMPOUND Mitsubishi Pharma Corporation (JP) 2007-06-27 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-20070265257-A1 Morpholine Compound CCR3, CCR1, CCR4 ALDH1A1 2661/4885LMNA 2526/4885SLC22A6 2936/4885

“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.