SCHEMBL887896

SCHEMBL887896

CN(C)/C=N/c1ncnc2c1ncn2[C@H]1CC[C@@H](CO)O1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ ALB P02768 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ CA2 P00918 4/20 0.41
▸ CA4 P22748 4/20 0.41
▸ CA9 Q16790 4/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ ADA P00813 1/20 0.40
▸ ABL1 P00519 2/20 0.39
▸ RIN1 Q13671 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL2113417 0.88 ALDH1A1 (0.48) ALDH1A1LMNAALBMAPK1CYP1A2
SCHEMBL2113420 0.88 ALDH1A1 (0.48) ALDH1A1LMNAALBMAPK1CYP1A2
SCHEMBL9601775 0.82 ALDH1A1 (0.60) ALDH1A1LMNAALBMAPK1CYP1A2
SCHEMBL17231789 0.82 HIF1A (0.48) HIF1AADA
SCHEMBL11688227 0.82 HIF1A (0.63) LMNAHIF1A
SCHEMBL887520 0.82 HIF1A (0.63) LMNAHIF1A
SCHEMBL20129803 0.82 HIF1A (0.63) LMNAHIF1A
SCHEMBL10022903 0.82 HIF1A (0.63) LMNAHIF1A
SCHEMBL11688219 0.82 HIF1A (0.63) LMNAHIF1A
SCHEMBL29738724 0.82 HIF1A (0.63) LMNAHIF1A

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-7883869-B2 for sequencing single-stranded DNA by employing a nanopore and modified nucleotides THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2011-02-08 — — US disclosed
US-20100092952-A1 FOUR-COLOR DNA SEQUENCING BY SYNTHESIS USING CLEAVABLE FLUORESCENT NUCLEOTIDE REVERSIBLE TERMINATORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-04-15 — — US disclosed
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