SCHEMBL2575270

SCHEMBL2575270

COc1ccc(C(OCC(O)Cn2cnc3c(=O)[nH]c(N)nc32)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 11/20 0.57
XDH P47989 2/20 0.49
PNP P00491 2/20 0.48
TYMP P19971 1/20 0.45
BLM P54132 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
NFKB1 P19838 1/20 0.44
VCP P55072 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HIF1A Q16665 1/20 0.44
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
EDNRA P25101 1/20 0.43
HTR2A P28223 1/20 0.43
RECQL P46063 1/20 0.43
HBB P68871 1/20 0.43

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
SCHEMBL2575266 1.00 HPRT1 (0.57) HPRT1XDHPNPTYMPBLM
SCHEMBL27041198 0.85 HPRT1 (0.40) HPRT1TYMPMEN1LMNAKMT2A
SCHEMBL27041175 0.85 HPRT1 (0.40) HPRT1TYMPMEN1LMNAKMT2A
SCHEMBL27041171 0.85 HPRT1 (0.40) HPRT1TYMPMEN1LMNAKMT2A
SCHEMBL2577678 0.84 CTSK (0.50) HPRT1XDHTYMPLMNA
SCHEMBL2577674 0.84 CTSK (0.50) HPRT1XDHTYMPLMNA
SCHEMBL2577682 0.84 CTSK (0.50) HPRT1XDHTYMPLMNA
SCHEMBL2567895 0.81 NSD3 (0.52) ALDH1A1LMNACYP3A4SMN1; SMN2
SCHEMBL14955424 0.81 NSD3 (0.52) ALDH1A1LMNACYP3A4SMN1; SMN2
SCHEMBL14955845 0.80 MGMT (0.42) TYMPMEN1ALDH1A1LMNACYP3A4

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 HPRT1 165/4885XDH 1824/4885PNP 240/4885
US-20130130378-A1 OLIGONUCLEOTIDES COMPRISING ACYCLIC AND ABASIC NUCLEOSIDES AND ANALOGS ADAR, TYMS, POLM HPRT1 33/4885XDH 1674/4885PNP 80/4885
US-20210087219-A1 OLIGONUCLEOTIDES COMPRISING ACYCLIC AND ABASIC NUCLEOSIDES AND ANALOGS NSUN2, BCDIN3D, RNGTT HPRT1 195/4885XDH 1715/4885PNP 281/4885

“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.