SCHEMBL16185999

SCHEMBL16185999

CC(=O)NC1C(C)OC(CO)C(CC2OC(C)C(O)C(O)C2O)C1OC1OC(CO)C(O)C(OC2(C(=O)O)CC(O)C(NC(C)=O)C([C@H](O)[C@H](O)CO)O2)C1O

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 2/20 0.64
▸ SELL P14151 1/20 0.64
▸ MAG P20916 7/20 0.62
▸ SIGLEC7 Q9Y286 6/20 0.58
▸ SELE P16581 4/20 0.55

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
SCHEMBL14648686 0.96 SELP (0.65) SELPSELLMAGSIGLEC7SELE
SCHEMBL23713170 0.96 SELP (0.65) SELPSELLMAGSIGLEC7SELE
SCHEMBL16185997 0.93 SELP (0.62) SELPSELLMAGSIGLEC7SELE
SCHEMBL13663173 0.93 MAG (0.68) SELPSELLMAGSIGLEC7SELE
SCHEMBL12681640 0.93 MAG (0.68) SELPSELLMAGSIGLEC7SELE
SCHEMBL22763983 0.92 SELP (0.72) SELPSELLMAGSIGLEC7SELE
SCHEMBL13541587 0.92 SELP (0.72) SELPSELLMAGSIGLEC7SELE
SCHEMBL16188535 0.91 SELP (0.62) SELPSELLMAGSIGLEC7SELE
SCHEMBL27420909 0.91 SELP (0.70) SELPSELLMAGSIGLEC7SELE
SCHEMBL25124354 0.91 SELP (0.70) SELPSELLMAGSIGLEC7SELE

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-9476883-B2 Cellular recognition conjugates and methods of use for the histological analysis of cancer tissue using MALDI-MS imaging GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) 2016-10-25 — — US disclosed
US-20140315220-A1 CELLULAR RECOGNITION CONJUGATES AND METHODS OF USE FOR THE HISTOLOGICAL ANALYSIS OF CANCER TISSUE USING MALDI-MS IMAGING GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) 2014-10-23 — — US disclosed
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