SCHEMBL10138504

SCHEMBL10138504

CCCOCCOCCOCC1O[C@H](OCC2O[C@H](OCC3O[C@H](O)C(O)[C@@H](O)[C@@H]3O)C(O)[C@@H](O)[C@@H]2O)C(O)[C@@H](O)[C@@H]1O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.44
GAA P10253 1/20 0.40
CDK1 P06493 1/20 0.40
CCNB1 P14635 1/20 0.40
IGF2R P11717 4/20 0.38
ACHE P22303 1/20 0.38
AMY2A P04746 2/20 0.37
CD209 Q9NNX6 1/20 0.37
GJB2 P29033 2/20 0.36

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
SCHEMBL10138503 0.89 SELP (0.38) CA2GJB2
SCHEMBL14231358 0.86 CA2 (0.35) CA2GAAGJB2
SCHEMBL4594969 0.86 CA2 (0.35) CA2GAAGJB2
SCHEMBL4594966 0.86 CA2 (0.35) CA2GAAGJB2
SCHEMBL13447456 0.82 CA2 (0.48) CA2GAACDK1CCNB1IGF2R
SCHEMBL12508190 0.82 CA2 (0.50) CA2GAACDK1CCNB1IGF2R
SCHEMBL13424104 0.82 CA2 (0.50) CA2GAACDK1CCNB1IGF2R
SCHEMBL12418558 0.82 CA2 (0.50) CA2GAACDK1CCNB1IGF2R
SCHEMBL13932836 0.81 CA2 (0.55) CA2GAACDK1CCNB1IGF2R
SCHEMBL14925477 0.79 GAA (0.48) GAA

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-20130310912-A1 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES (US) 2013-11-21 US disclosed
US-20120046735-A1 PLASMA MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES, INCORPORATED (US) 2012-02-23 US disclosed
US-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES (US) 2012-02-23 US disclosed
US-8066824-B2 Covalent modification of metal surfaces INTEZYNE TECHNOLOGIES, INC. (US) 2011-11-29 US disclosed
US-20080035243-A1 Covalent modification of metal surfaces INTEZYNE TECHNOLOGIES (US) 2008-02-14 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 (2 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-20080035243-A1 Covalent modification of metal surfaces ITGAL, ITGA1, ITGA5 CA2 320/4885GAA 1209/4885CDK1 4002/4885
US-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES ITGAL, ITGA1, ITGA5 CA2 320/4885GAA 1209/4885CDK1 4002/4885

“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.