SCHEMBL10138503

SCHEMBL10138503

CCCOCCOCCOCC1O[C@H](O)C(O)[C@@H](O)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SELP P16109 2/20 0.38
SPHK2 Q9NRA0 1/20 0.35
CA2 P00918 1/20 0.33
AMDHD2 Q9Y303 1/20 0.32
GJB2 P29033 4/20 0.32
FBP1 P09467 1/20 0.32
PYGB P11216 1/20 0.31
TLR4 O00206 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
SCHEMBL4594969 0.96 CA2 (0.35) SELPSPHK2CA2AMDHD2GJB2
SCHEMBL4594966 0.96 CA2 (0.35) SELPSPHK2CA2AMDHD2GJB2
SCHEMBL14231358 0.96 CA2 (0.35) SELPSPHK2CA2AMDHD2GJB2
SCHEMBL10138504 0.89 CA2 (0.44) CA2GJB2
SCHEMBL12289162 0.86 SELP (0.35) SELPCA2AMDHD2FBP1PYGB
SCHEMBL20932845 0.84 FBP1 (0.36) SELPCA2AMDHD2FBP1PYGB
SCHEMBL17848795 0.83 ALDH1A1 (0.46) SELPSPHK2GJB2TLR4
SCHEMBL17848813 0.83 ALDH1A1 (0.46) SELPSPHK2GJB2TLR4
SCHEMBL17848806 0.83 ALDH1A1 (0.46) SELPSPHK2GJB2TLR4
SCHEMBL30610704 0.81 CA2 (0.36) SELPCA2AMDHD2FBP1PYGB

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-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES (US) 2012-02-23 US disclosed
US-20120046735-A1 PLASMA MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES, INCORPORATED (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 SELP 125/4885SPHK2 4627/4885CA2 320/4885
US-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES ITGAL, ITGA1, ITGA5 SELP 125/4885SPHK2 4627/4885CA2 320/4885

“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.