SCHEMBL2567895

SCHEMBL2567895

COc1ccc(C(OC[C@@H](O)Cn2cnc3c(N)ncnc32)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NSD3 Q9BZ95 2/20 0.52
ADORA2A P29274 4/20 0.51
AHCY P23526 2/20 0.51
ADORA1 P30542 1/20 0.49
ALDH1A1 P00352 1/20 0.47
PI4KA P42356 4/20 0.45
PI4K2B Q8TCG2 4/20 0.45
PI4K2A Q9BTU6 4/20 0.45
PI4KB Q9UBF8 4/20 0.45
NSD2 O96028 1/20 0.45
EGFR P00533 2/20 0.43
HPGD P15428 2/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL14955424 1.00 NSD3 (0.52) NSD3ADORA2AAHCYADORA1ALDH1A1
SCHEMBL29249897 0.87 NSD3 (0.53) NSD3ADORA2AAHCYADORA1ALDH1A1
SCHEMBL29249895 0.87 NSD3 (0.53) NSD3ADORA2AAHCYADORA1ALDH1A1
SCHEMBL2563455 0.83 CTSK (0.47) NSD3ADORA2AAHCYHPGDSMN1; SMN2
SCHEMBL2563452 0.83 CTSK (0.47) NSD3ADORA2AAHCYHPGDSMN1; SMN2
SCHEMBL2563457 0.83 CTSK (0.47) NSD3ADORA2AAHCYHPGDSMN1; SMN2
SCHEMBL2575266 0.81 HPRT1 (0.57) ALDH1A1LMNASMN1; SMN2CYP3A4
SCHEMBL2575270 0.81 HPRT1 (0.57) ALDH1A1LMNASMN1; SMN2CYP3A4
SCHEMBL14955846 0.80 MGMT (0.42) ADORA2AADORA1ALDH1A1HPGDLMNA
SCHEMBL14955845 0.80 MGMT (0.42) ADORA2AADORA1ALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210087219-A1 OLIGONUCLEOTIDES COMPRISING ACYCLIC AND ABASIC NUCLEOSIDES AND ANALOGS ALNYLAM PHARMACEUTICALS INC (US) 2021-03-25 US disclosed
US-10913767-B2 Oligonucleotides comprising acyclic and abasic nucleosides and analogs ALNYLAM PHARMACEUTICALS, INC. (US) 2021-02-09 US disclosed
US-20130130378-A1 OLIGONUCLEOTIDES COMPRISING ACYCLIC AND ABASIC NUCLEOSIDES AND ANALOGS ALNYLAM PHARMACEUTICALS, INC. (US) 2013-05-23 US disclosed
WO-2011133876-A2 OLIGONUCLEOTIDES COMPRISING ACYCLIC AND ABASIC NUCLEOSIDES AND ANALOGS ALNYLAM PHARMACEUTICALS, INC. (US) 2011-10-27 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 (3 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-10913767-B2 Oligonucleotides comprising acyclic and abasic nucleosides and analogs NSUN2, BCDIN3D, ADAR NSD3 1377/4885ADORA2A 660/4885AHCY 1111/4885
US-20130130378-A1 OLIGONUCLEOTIDES COMPRISING ACYCLIC AND ABASIC NUCLEOSIDES AND ANALOGS ADAR, TYMS, POLM NSD3 1273/4885ADORA2A 169/4885AHCY 510/4885
US-20210087219-A1 OLIGONUCLEOTIDES COMPRISING ACYCLIC AND ABASIC NUCLEOSIDES AND ANALOGS NSUN2, BCDIN3D, RNGTT NSD3 1568/4885ADORA2A 632/4885AHCY 1239/4885

“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.