SCHEMBL1170783

SCHEMBL1170783

CCCC/C=C/[C@@H](O)[C@H](C[C@H]1O[C@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 11/20 0.56
▸ CETP P11597 3/20 0.47
▸ THRB P10828 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ FAAH O00519 2/20 0.47
▸ PLA2G4A P47712 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
SCHEMBL1170785 1.00 SELP (0.56) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170786 1.00 SELP (0.56) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170900 0.98 SELP (0.58) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170902 0.98 SELP (0.58) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170905 0.98 SELP (0.58) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170808 0.95 SELP (0.53) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170807 0.95 SELP (0.53) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170806 0.95 SELP (0.53) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170914 0.92 SELP (0.51) SELPCETPTHRBMEN1KMT2A
SCHEMBL1170915 0.92 SELP (0.51) SELPCETPTHRBMEN1KMT2A

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-8211859-B2 α-galactoceramide analogs, their methods of manufacture, intermediate compounds useful in these methods, and pharmaceutical compositions containing them CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-07-03 — — US disclosed
US-20110028411-A1 ALPHA-GALACTOCERAMIDE ANALOGS, THEIR METHODS OF MANUFACTURE, INTERMEDIATE COMPOUNDS USEFUL IN THESE METHODS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFQUE (FR) 2011-02-03 — — 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-20110028411-A1 ALPHA-GALACTOCERAMIDE ANALOGS, THEIR METHODS OF MANUFACTURE, INTERMEDIATE COMPOUNDS USEFUL IN THESE METHODS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GALE, GALNT14, GALC SELP 4550/4885CETP 216/4885THRB 2757/4885

“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.

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