SCHEMBL3499237

SCHEMBL3499237

CC(C)C(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)C(O)C1O

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.64
ADORA2B P29275 1/20 0.64
TP53 P04637 1/20 0.64
CYP3A4 P08684 1/20 0.64
TSHR P16473 1/20 0.64
ALOX12 P18054 1/20 0.64
NFKB1 P19838 1/20 0.64
HIF1A Q16665 1/20 0.64
ALDH1A1 P00352 1/20 0.64
HPGD P15428 1/20 0.64
PMP22 Q01453 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
SCHEMBL3499233 1.00 ADORA2A (0.64) ADORA2AADORA2BTP53CYP3A4TSHR
SCHEMBL2480941 0.92 ADORA2A (0.62) ADORA2AADORA2BTP53CYP3A4TSHR
SCHEMBL31439427 0.91 ADORA2A (0.61) ADORA2AADORA2BTP53CYP3A4TSHR
SCHEMBL28645388 0.91 ADORA2A (0.56) ADORA2AADORA2BTP53CYP3A4TSHR
SCHEMBL29047902 0.90 ADORA2A (0.60) ADORA2AADORA2BTP53CYP3A4TSHR
SCHEMBL29047905 0.90 ADORA2A (0.60) ADORA2AADORA2BTP53CYP3A4TSHR
SCHEMBL2761074 0.89 MEN1 (0.66) ADORA2AADORA2B
SCHEMBL3500482 0.89 MEN1 (0.66) ADORA2AADORA2B
SCHEMBL6429185 0.89 ADORA3 (0.66)
SCHEMBL155837 0.89 SLC29A1 (0.75) ADORA2AADORA2BALDH1A1PMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1986697-B1 COMPOSITIONS AND METHODS FOR INHIBITING GENE SILENCING BY RNA INTERFERENCE GE HEALTHCARE DHARMACON INC (US) 2016-06-29 EP disclosed
US-7834171-B2 Modified polynucleotides for reducing off-target effects in RNA interference DHARMACON, INC. (US) 2010-11-16 US disclosed
US-20100184209-A1 COMPOSITIONS AND METHODS FOR INHIBITING GENE SILENCING BY RNA INTERFERENCE DHARMACON, INC. (US) 2010-07-22 US disclosed
EP-1986697-A2 COMPOSITIONS AND METHODS FOR INHIBITING GENE SILENCING BY RNA INTERFERENCE Dharmacon, Inc. (US) 2008-11-05 EP disclosed
US-20080242851-A1 MODIFIED POLYNUCLEOTIDES FOR REDUCING OFF-TARGET EFFECTS IN RNA INTERFERENCE DHARMACON, INC. (US) 2008-10-02 US disclosed
WO-2007095387-A2 COMPOSITIONS AND METHODS FOR INHIBITING GENE SILENCING BY RNA INTERFERENCE DHARMACON, INC. (US) 2007-08-23 WO disclosed
US-20070173476-A1 MODIFIED POLYNUCLEOTIDES FOR USE IN RNA INTERFERENCE DHARMACON INC. (US) 2007-07-26 US disclosed
US-20060223777-A1 Highly functional short hairpin RNA DHARMACON, INC. 2006-10-05 US disclosed
US-20050223427-A1 Modified polynucleotides for reducing off-target effects in RNA interference DHARMACON, INC. (US) 2005-10-06 US 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-20070173476-A1 MODIFIED POLYNUCLEOTIDES FOR USE IN RNA INTERFERENCE PHAX, NSUN2, RNMT ADORA2A 1375/4885ADORA2B 1284/4885TP53 1570/4885

“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.