SCHEMBL18503534

SCHEMBL18503534

NC1C(=O)C=CN([C@@H]2O[C@H](CO)[C@H](O)C2O)C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ MTOR P42345 2/20 0.43
▸ THPO P40225 2/20 0.43
▸ PMP22 Q01453 2/20 0.43
▸ THRB P10828 1/20 0.43
▸ MDM2 Q00987 1/20 0.43
▸ NCOA1 Q15788 1/20 0.43
▸ NCOA3 Q9Y6Q9 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ GMNN O75496 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ DNMT1 P26358 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ HBB P68871 1/20 0.43
▸ CDA P32320 5/20 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
SCHEMBL18503533 0.86 LMNA (0.41) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL29395281 0.73 CDA (0.46) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL18503561 0.73 PNP (0.39) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL6424353 0.72 CDA (0.45) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL25458669 0.71 PYGM (0.44) LMNAALDH1A1MTORTHPOPMP22
SCHEMBL288668 0.71 LMNA (0.42) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL8600538 0.70 CDA (0.47) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL8600543 0.70 CDA (0.47) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL40870 0.70 LMNA (0.41) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL14853698 0.69 PYGM (0.48) LMNASMN1; SMN2ALDH1A1MTORTHPO

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-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
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