SCHEMBL7125885

SCHEMBL7125885

O=CNc1cn(C2COC(CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALOX12 P18054 1/20 0.37
ADRA1A P35348 1/20 0.37
TK2 O00142 1/20 0.36

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
SCHEMBL7116002 0.80 LMNA (0.43) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL7115997 0.80 LMNA (0.43) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL1129572 0.79 LMNA (0.55) TK1LMNATSHRBLMPMP22
SCHEMBL6760136 0.79 LMNA (0.55) TK1LMNATSHRBLMPMP22
SCHEMBL1130181 0.79 LMNA (0.55) TK1LMNATSHRBLMPMP22
SCHEMBL7701755 0.79 LMNA (0.55) TK1LMNATSHRBLMPMP22
SCHEMBL6753208 0.79 SMN1; SMN2 (0.54) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL6752642 0.79 LMNA (0.60) TK1LMNASMN1; SMN2TSHRPMP22
SCHEMBL1129570 0.79 LMNA (0.55) TK1LMNATSHRBLMPMP22
SCHEMBL6314490 0.79 LMNA (0.55) TK1LMNATSHRBLMPMP22

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
EP-1361227-A2 [5-carboxamide or 5-fluoro]-[2', 3'-unsaturated or 3'-modifield]-pyrimidine nucleosides Emory University (US) 2003-11-12 EP claimed