SCHEMBL13222053

SCHEMBL13222053

O=C(CF)NCC#Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ TK1 P04183 3/20 0.55
▸ ALOX12 P18054 1/20 0.55
▸ ADRA1A P35348 1/20 0.55
▸ TK2 O00142 1/20 0.54
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ BLM P54132 1/20 0.51
▸ PMP22 Q01453 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL25470065 0.93 TK1 (0.57) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL8925580 0.92 TK1 (0.59) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL8925599 0.92 TK1 (0.59) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL8926757 0.90 TK1 (0.52) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL8926762 0.90 TK1 (0.52) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL29757418 0.90 TK1 (0.58) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL18214117 0.88 LMNA (0.59) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL21585062 0.88 LMNA (0.59) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL2611574 0.88 LMNA (0.59) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL2030383 0.88 LMNA (0.59) LMNASMN1; SMN2TK1ALOX12ADRA1A

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-7771973-B2 sequencing reactions where nucleotide or nucleoside molecules modified by reversible covalent attachment of 3'-OH blocking groups thereto, are used where blocked nucleotide or nucleoside molecules are required ILLUMINA CAMBRIDGE LIMITED (GB) 2010-08-10 — — US disclosed
US-20090325172-A1 Modified nucleotides SOLEXA LIMITED 2009-12-31 — — US disclosed
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