SCHEMBL887895

SCHEMBL887895

CC[C@@H](CO)OCn1cc(I)c(N)nc1=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
NFKB1 P19838 1/20 0.39
BLM P54132 1/20 0.39
VCP P55072 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
FGFR1 P11362 3/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
PDE3A Q14432 1/20 0.33

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
SCHEMBL13847093 0.80 FGFR1 (0.31) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL13379601 0.76 ALDH1A1 (0.48) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL12985338 0.76 FGFR1 (0.57) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL13475404 0.76 MEN1 (0.36) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL13060279 0.76 BLM (0.54) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL13071348 0.75 BLM (0.47) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL8845705 0.74 PNP (0.44) BLM
SCHEMBL13475348 0.68 ADK (0.41) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL9666275 0.67 BLM (0.55) MEN1ALDH1A1LMNACYP3A4NFKB1
SCHEMBL543442 0.67 FGFR1 (0.62) MEN1ALDH1A1LMNACYP3A4NFKB1

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