SCHEMBL21998920

SCHEMBL21998920

COCC1OC(n2cc(C)c(N)nc2=O)C(O)C1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADK P55263 3/20 0.52
ADORA3 P0DMS8 1/20 0.52
LMNA P02545 2/20 0.46
MTOR P42345 2/20 0.46
THRB P10828 1/20 0.46
MDM2 Q00987 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
GMNN O75496 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
NFKB1 P19838 1/20 0.46
DNMT1 P26358 1/20 0.46
THPO P40225 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
BLM P54132 1/20 0.46
HBB P68871 1/20 0.46
PMP22 Q01453 1/20 0.46
P2RY2 P41231 2/20 0.45

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
SCHEMBL1684799 1.00 ADK (0.52) ADKADORA3LMNAMTORTHRB
SCHEMBL24264139 0.91 ADK (0.43) ADKADORA3LMNAMTORTHRB
SCHEMBL234387 0.91 LMNA (0.46) ADKADORA3LMNAMTORTHRB
SCHEMBL2534936 0.90 P2RY2 (0.43) ADKADORA3LMNAMTORTHRB
SCHEMBL21999227 0.90 PRMT5 (0.44) ADKADORA3PRMT5
SCHEMBL21999231 0.90 ADK (0.42) ADKADORA3LMNAMTORTHRB
SCHEMBL17979623 0.89 ADK (0.53) ADKADORA3LMNAMTORTHRB
SCHEMBL7654643 0.89 P2RY6 (0.43) ADKADORA3LMNAMTORTHRB
SCHEMBL17748441 0.88 ADORA3 (0.53) ADORA3LMNAMTORTHRBMDM2
SCHEMBL24798428 0.88 LMNA (0.45) ADKADORA3LMNAMTORTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200147124-A1 S-ANTIGEN TRANSPORT INHIBITING OLIGONUCLEOTIDE POLYMERS AND METHODS ALIGOS THERAPEUTICS, INC. 2020-05-14 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-20200147124-A1 S-ANTIGEN TRANSPORT INHIBITING OLIGONUCLEOTIDE POLYMERS AND METHODS RNGTT, PHAX, HAVCR2 ADK 1820/4885ADORA3 1372/4885LMNA 2852/4885

“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.