SCHEMBL12136337

SCHEMBL12136337

C[C@@H]1C(OCc2ccccc2)[C@H](OCc2ccccc2)OC(COCc2ccccc2)[C@H]1O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.48
CDC25B P30305 6/20 0.48
GJB2 P29033 1/20 0.48
SLC6A2 P23975 1/20 0.47
PTPN2 P17706 2/20 0.46
PTPN6 P29350 2/20 0.46
PTPN11 Q06124 2/20 0.46
NT5E P21589 1/20 0.46
SSTR4 P31391 2/20 0.45
SSTR5 P35346 2/20 0.45
SSTR1 P30872 1/20 0.45
SSTR2 P30874 1/20 0.45
SSTR3 P32745 1/20 0.45
TACR2 P21452 1/20 0.45
HTR1A P08908 1/20 0.44

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
SCHEMBL13308240 0.90 NT5E (0.48) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL15144319 0.90 GJB2 (0.49) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL25912875 0.90 SLC6A2 (0.49) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL18470831 0.88 TACR2 (0.45) PTPN1CDC25BGJB2SLC6A2NT5E
SCHEMBL24479039 0.88 SLC6A2 (0.53) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL7639364 0.88 NT5E (0.51) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL10865849 0.88 SLC6A2 (0.53) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL7154719 0.88 NT5E (0.51) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL7156143 0.88 NT5E (0.51) PTPN1CDC25BGJB2SLC6A2PTPN2
SCHEMBL23742931 0.88 NT5E (0.51) PTPN1CDC25BGJB2SLC6A2PTPN2

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-20110286937-A1 SYNTHETIC GLYCOLIPID-CONTAINING LIPOSOME GIFU UNIVERSITY (JP) 2011-11-24 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-20110286937-A1 SYNTHETIC GLYCOLIPID-CONTAINING LIPOSOME UGCG, SGMS2, CERT1 PTPN1 3852/4885CDC25B 1247/4885GJB2 4133/4885

“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.