SCHEMBL2056653

SCHEMBL2056653

C=CCn1c(=O)c(C)cn([C@H]2C[C@H](O)[C@@H](CO)O2)c1=O

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TK1 P04183 3/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TK2 O00142 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALOX12 P18054 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRB1 P08588 1/20 0.42
DNMT1 P26358 1/20 0.42

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
SCHEMBL16213065 0.89 TK1 (0.45) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL17037310 0.89 TK1 (0.45) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL27592029 0.87 TK1 (0.49) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL2056832 0.86 TK1 (0.50) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL12749219 0.83 LMNA (0.48) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL12718452 0.83 LMNA (0.48) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL31435159 0.83 TK1 (0.46) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL12718189 0.83 LMNA (0.48) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL12718341 0.83 LMNA (0.48) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL16964213 0.83 TK1 (0.40) TK1LMNASMN1; SMN2TK2CYP1A2

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