Sugi Predict

Sugi Predict / Compounds / SCHEMBL13348735

SCHEMBL13348735

SCHEMBL13348735

CCCCCc1ccc(-c2ccc(CCCCC(=O)N[C@@H](COC3OC(COCCCC)C(OCCCC)C(OCCCC)C3OCCCC)[C@H](O)[C@@H](C)O)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 15/20 0.41
▸ ITGB3 P05106 1/20 0.34
▸ ITGA2B P08514 1/20 0.34
▸ TNF P01375 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ CDC25B P30305 1/20 0.33
▸ ENPP2 Q13822 1/20 0.33
▸ TACR1 P25103 1/20 0.33

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
SCHEMBL12228251 0.93 SELP (0.40) SELP
SCHEMBL12228224 0.93 SELP (0.40) SELPITGB3ITGA2BTNFENPP2
SCHEMBL12227937 0.90 SELP (0.38) SELPPTPN1CDC25BENPP2
SCHEMBL12227936 0.86 SELP (0.46) SELPTNFENPP2TACR1
SCHEMBL12228815 0.84 SELP (0.48) SELPTNFENPP2TACR1
SCHEMBL12228221 0.83 SELP (0.43) SELP
SCHEMBL12228229 0.83 ENPP2 (0.43) SELPENPP2
SCHEMBL12227930 0.82 SELP (0.35) SELPITGB3ITGA2BTNF
SCHEMBL12228123 0.82 MEN1 (0.43) SELP
SCHEMBL12202058 0.82 SELP (0.52) SELPPTPN1CDC25B

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-7732583-B2 Glycolipids and synthetic method thereof as well as their synthetic intermediates, and synthetic intermediates, and synthetic method thereof JAPAN AS REPRESENTED BY PRESIDENT OF NATIONAL CENTER OF NEUROLOGY AND PSYCHIATRY (JP) 2010-06-08 — — US disclosed
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