SCHEMBL2056737

SCHEMBL2056737

CCCCCCCCCCCCCC(=O)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)CC1O

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 3/20 0.68
ABCB1 P08183 1/20 0.68
TK2 O00142 3/20 0.59
POLB P06746 1/20 0.57
TK1 P04183 2/20 0.56

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
SCHEMBL5367768 1.00 ABCG2 (0.68) ABCG2ABCB1TK2POLBTK1
SCHEMBL5358026 1.00 ABCG2 (0.68) ABCG2ABCB1TK2POLBTK1
SCHEMBL5372686 1.00 ABCG2 (0.68) ABCG2ABCB1TK2POLBTK1
SCHEMBL5360915 1.00 ABCG2 (0.68) ABCG2ABCB1TK2POLBTK1
SCHEMBL1145611 1.00 ABCG2 (0.68) ABCG2ABCB1TK2POLBTK1
SCHEMBL5360913 1.00 ABCG2 (0.68) ABCG2ABCB1TK2POLBTK1
SCHEMBL5367832 0.96 ABCG2 (0.65) ABCG2ABCB1TK2POLBTK1
SCHEMBL1146084 0.90 ABCG2 (0.63) ABCG2ABCB1POLBTK1
SCHEMBL11578220 0.90 LMNA (0.60) ABCG2ABCB1TK2TK1
SCHEMBL22875462 0.90 ABCG2 (0.67) ABCG2ABCB1TK2TK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110104754-A1 CELL CULTURE MEDIUM GENETIX LIMITED 2011-05-05 US disclosed
EP-1818392-B1 Cell culture medium GENETIX LTD (GB) 2010-08-25 EP disclosed
US-20070212778-A1 Cell culture medium GENETIX LIMITED 2007-09-13 US disclosed
EP-1818392-A1 Cell culture medium Genetix Limited (GB) 2007-08-15 EP disclosed