SCHEMBL4300142

SCHEMBL4300142

O=c1[nH]c(C2CC(O)C(CO)O2)c(I)c(=O)[nH]1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK1 P04183 3/20 0.44
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
SCHEMBL4307219 0.83 LMNA (0.44) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL12988358 0.81 TK1 (0.42) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL2636826 0.80 LMNA (0.45) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL18190788 0.76 DNMT1 (0.39) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL31565646 0.74 PYGM (0.41) LMNA
SCHEMBL23892079 0.72 TK1 (0.41) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL12642442 0.72 TK1 (0.41) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL658719 0.72 TK1 (0.41) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL2641583 0.72 TK1 (0.41) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL29973585 0.71 PYGM (0.36) SMN1; SMN2TK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9803240-B2 Stabilized nucleic acid dark quencher-fluorophore probes BIOSEARCH TECHNOLOGIES, INC. (US) 2017-10-31 US disclosed
US-9803240-B2 Stabilized nucleic acid dark quencher-fluorophore probes BIOSEARCH TECHNOLOGIES, INC. (US) 2017-10-31 US disclosed
US-20140194611-A1 STABILIZED NUCLEIC ACID DARK QUENCHER-FLUOROPHORE PROBES BIOSEARCH TECHNOLOGIES, INC. (US) 2014-07-10 US disclosed
US-20140194611-A1 STABILIZED NUCLEIC ACID DARK QUENCHER-FLUOROPHORE PROBES BIOSEARCH TECHNOLOGIES, INC. (US) 2014-07-10 US disclosed
WO-2009129094-A2 COMPOSITIONS CONTAINING ANTIVIRAL COMPOUNDS AND METHODS OF USING THE SAME MALLINCKRODT INC. (US) 2009-10-22 WO disclosed