SCHEMBL7168674

SCHEMBL7168674

CC(=O)NNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 3/20 0.67
ADORA1 P30542 2/20 0.64
LMNA P02545 2/20 0.64
ALDH1A1 P00352 1/20 0.64
GLA P06280 1/20 0.64
PMP22 Q01453 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
ADORA3 P0DMS8 1/20 0.64
NPC1 O15118 1/20 0.64
NPY1R P25929 1/20 0.64
HTT P42858 1/20 0.64
NPY2R P49146 1/20 0.64
RAB9A P51151 1/20 0.64
RXFP1 Q9HBX9 1/20 0.64

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
SCHEMBL926077 0.91 SLC29A1 (0.66) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL28894286 0.90 SLC29A1 (0.65) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL155837 0.89 SLC29A1 (0.75) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL155836 0.89 SLC29A1 (0.75) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL28821444 0.88 SLC29A1 (0.63) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL8708994 0.87 SLC29A1 (0.69) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL8709002 0.87 SLC29A1 (0.69) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL5252809 0.87 SLC29A1 (0.70) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL5252821 0.87 SLC29A1 (0.70) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL6382045 0.87 TSHR (0.66) SLC29A1ADORA1PMP22SMN1; SMN2ADORA3

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-11209440-B2 T cell balance gene expression, compositions of matters and methods of use thereof THE BROAD INSTITUTE, INC. 2021-12-28 US disclosed
US-20160377631-A1 T CELL BALANCE GENE EXPRESSION, COMPOSITIONS OF MATTERS AND METHODS OF USE THEREOF THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2016-12-29 US disclosed
CN-1671716-A Method of treating ischemia reperfusion injury using adenosine receptor antagonists BIOGEN IDEC INC (US) 2005-09-21 CN disclosed
US-6586413-B2 Methods and compositions for reducing ischemic injury of the heart by administering adenosine receptor agonists and antagonists THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2003-07-01 US disclosed
US-6211165-B1 GENE EXPRESSION; BINARY CONJUGATES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2001-04-03 US disclosed