SCHEMBL16631429

SCHEMBL16631429

O=c1[nH]c(=O)n(Cc2cn(Cc3ccccc3)nn2)cc1[C@@H]1O[C@H](CO)C(O)[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
OGA O60502 1/20 0.40
SLC5A2 P31639 1/20 0.40
BCHE P06276 2/20 0.39
TK1 P04183 2/20 0.39
CYP19A1 P11511 2/20 0.39
TK2 O00142 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
ADORA1 P30542 1/20 0.38

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
SCHEMBL16631424 0.88 SLC5A2 (0.39) SLC5A2BCHE
SCHEMBL18852587 0.87 HPGD (0.49) SLC5A2TK2
SCHEMBL15798913 0.87 HPGD (0.49) SLC5A2TK2
SCHEMBL15810628 0.87 HPGD (0.49) SLC5A2TK2
SCHEMBL18159000 0.87 HPGD (0.49) SLC5A2TK2
SCHEMBL16631426 0.87 CA1 (0.44)
SCHEMBL16631458 0.86 TK1 (0.46) OGASLC5A2BCHETK1TK2
SCHEMBL18080117 0.84 P2RY2 (0.45)
SCHEMBL16631548 0.84 PYGM (0.38) SLC5A2TK2
SCHEMBL16631390 0.81 LGALS3 (0.40) OGASLC5A2TK1TK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 US disclosed
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 US disclosed
WO-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF POLRMT, POLN, NSUN3 SIRT2 3208/4885SIRT1 3387/4885OGA 1395/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.