SCHEMBL18503561

SCHEMBL18503561

C=C1C(N)C(=N)C=CN1[C@@H]1O[C@H](CO)[C@H](O)C1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 3/20 0.39
▸ LMNA P02545 6/20 0.36
▸ SMN1; SMN2 Q16637 5/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ MTOR P42345 2/20 0.36
▸ THPO P40225 2/20 0.36
▸ PMP22 Q01453 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ BLM P54132 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ MDM2 Q00987 1/20 0.36
▸ NCOA1 Q15788 1/20 0.36
▸ NCOA3 Q9Y6Q9 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ GMNN O75496 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ DNMT1 P26358 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ HBB P68871 1/20 0.36

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 0.84 LMNA (0.41) PNPLMNASMN1; SMN2ALDH1A1MTOR
SCHEMBL18503534 0.73 LMNA (0.43) LMNASMN1; SMN2ALDH1A1MTORTHPO
SCHEMBL17752033 0.72 LMNA (0.42) PNPLMNASMN1; SMN2ALDH1A1MTOR
SCHEMBL15459909 0.72 LMNA (0.42) PNPLMNASMN1; SMN2ALDH1A1MTOR
SCHEMBL25458669 0.69 PYGM (0.44) LMNAALDH1A1MTORTHPOPMP22
SCHEMBL25843063 0.69 LMNA (0.38) PNPLMNASMN1; SMN2ALDH1A1MTOR
SCHEMBL17732549 0.69 ADORA2A (0.41) PNPLMNASMN1; SMN2ALDH1A1MTOR
SCHEMBL27344654 0.68 LMNA (0.38) PNPLMNASMN1; SMN2ALDH1A1MTOR
SCHEMBL26326168 0.68 LMNA (0.38) PNPLMNASMN1; SMN2ALDH1A1MTOR
SCHEMBL288668 0.67 LMNA (0.42) 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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