SCHEMBL18513007

SCHEMBL18513007

Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2C=O)cc1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
MTOR P42345 2/20 0.47
ALDH1A1 P00352 2/20 0.47
THRB P10828 1/20 0.47
MDM2 Q00987 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
GMNN O75496 1/20 0.47
TP53 P04637 1/20 0.47
NFKB1 P19838 1/20 0.47
DNMT1 P26358 1/20 0.47
THPO P40225 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
BLM P54132 1/20 0.47
HBB P68871 1/20 0.47
PMP22 Q01453 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.39

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
SCHEMBL14853910 0.90 LMNA (0.59) LMNAMTORALDH1A1THRBMDM2
SCHEMBL453967 0.90 LMNA (0.59) LMNAMTORALDH1A1THRBMDM2
SCHEMBL453966 0.90 LMNA (0.59) LMNAMTORALDH1A1THRBMDM2
SCHEMBL18512862 0.86 LMNA (0.47) LMNAMTORALDH1A1THRBMDM2
SCHEMBL15810801 0.84 LMNA (0.45) LMNAMTORALDH1A1THRBMDM2
SCHEMBL20579928 0.84 LMNA (0.45) LMNAMTORALDH1A1THRBMDM2
SCHEMBL1274190 0.84 LMNA (0.45) LMNAMTORALDH1A1THRBMDM2
SCHEMBL18503543 0.84 LMNA (0.45) LMNAMTORALDH1A1THRBMDM2
SCHEMBL1274188 0.84 LMNA (0.45) LMNAMTORALDH1A1THRBMDM2
SCHEMBL18512947 0.84 LMNA (0.45) LMNAMTORALDH1A1THRBMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339441-B2 Profiling chemically modified DNA/RNA units for disease and cancer diagnosis THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2022-05-24 US disclosed
US-20170044619-A1 PROFILING CHEMICALLY MODIFIED DNA/RNA UNITS FOR DISEASE AND CANCER DIAGNOSIS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2017-02-16 US disclosed