SCHEMBL16631507

SCHEMBL16631507

C#Cc1[nH]c(=O)c(C)nc1[C@@H]1O[C@H](CO)C(O)[C@@H]1OC

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.32
LGALS3 P17931 1/20 0.32
GSK3B P49841 1/20 0.32
LGALS8 O00214 3/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
PNP P00491 2/20 0.31
TNF P01375 1/20 0.31
IL6 P05231 1/20 0.31
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
TK2 O00142 2/20 0.30
SLC5A2 P31639 2/20 0.30

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
SCHEMBL16631219 0.88 OGA (0.32) OGALGALS3GSK3BLGALS8PNP
SCHEMBL16631822 0.88 OGA (0.35) OGALGALS3GSK3BLGALS8PNP
SCHEMBL16631238 0.88 UMPS (0.39) OGAGSK3BPNPLMNATSHR
SCHEMBL16631169 0.84 CDA (0.32) OGAGSK3BPNPLMNA
SCHEMBL16631815 0.83 OGA (0.34) OGALGALS3GSK3BLGALS8PNP
SCHEMBL16631596 0.80 PYGL (0.33) OGALGALS3LGALS8ADORA3ADORA2A
SCHEMBL16631574 0.78 TK2 (0.36) LGALS3LGALS8TNFIL6LMNA
SCHEMBL18081723 0.78
SCHEMBL16631508 0.77 TNF (0.32) LGALS8TNFIL6LMNATSHR
SCHEMBL16631252 0.75 UMPS (0.39) GSK3BPNPLMNATSHRSLC5A2

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 OGA 1395/4885LGALS3 2438/4885GSK3B 3253/4885

“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.