SCHEMBL4274371

SCHEMBL4274371

COC1(C)O[C@@H]2[C@@H](OC1(C)OC)[C@H](C)O[C@@H](Sc1ccccc1)[C@@H]2OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 3/20 0.40
GSTA2 P09210 2/20 0.36
GSTM1 P09488 2/20 0.36
SSTR1 P30872 1/20 0.30
SSTR2 P30874 1/20 0.30
SSTR4 P31391 1/20 0.30
SSTR3 P32745 1/20 0.30
SSTR5 P35346 1/20 0.30
PDPK1 O15530 1/20 0.30
MTOR P42345 1/20 0.30

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
SCHEMBL13657214 1.00 GSTP1 (0.40) GSTP1GSTA2GSTM1SSTR1SSTR2
SCHEMBL582951 0.90 MEN1 (0.32) GSTP1PDPK1MTOR
SCHEMBL7458038 0.84 TACR1 (0.36)
SCHEMBL583131 0.83 TACR1 (0.34)
SCHEMBL5017349 0.80 GSTP1 (0.51) GSTP1GSTA2GSTM1SSTR1SSTR2
SCHEMBL14094693 0.80 GSTP1 (0.51) GSTP1GSTA2GSTM1SSTR1SSTR2
SCHEMBL13657211 0.80 GSTP1 (0.32) GSTP1GSTA2GSTM1
SCHEMBL4279232 0.80 GSTP1 (0.32) GSTP1GSTA2GSTM1
SCHEMBL5691292 0.78 L3MBTL1 (0.35) PDPK1MTOR
SCHEMBL13858947 0.78 PDPK1 (0.40) SSTR1SSTR2SSTR4SSTR3SSTR5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605241-B2 Synthesis of inhibitors of p90Rsk UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2009-10-20 US disclosed
US-20080269144-A1 Synthesis of Inhibitors of P90Rsk UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2008-10-30 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-20080269144-A1 Synthesis of Inhibitors of P90Rsk RAF1, KSR1, STK10 GSTP1 2365/4885GSTA2 3896/4885GSTM1 2905/4885

“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.