SCHEMBL889922

SCHEMBL889922

[2H]C[C@H]1O[C@@H](n2ncc3c(NC(=O)c4ccccc4)ncnc32)CC1OC(=O)CCC(=O)NC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ RET P07949 5/20 0.36
▸ KDR P35968 5/20 0.36
▸ SIGMAR1 Q99720 1/20 0.35
▸ MAPK14 Q16539 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL889888 0.93 RET (0.37) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL12601697 0.89 POLB (0.37) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL13889495 0.89 POLB (0.37) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL12601698 0.82 POLB (0.38) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL13889497 0.82 POLB (0.38) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL889728 0.81 MAPT (0.41) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL889896 0.74 CDK4 (0.34) —
SCHEMBL26298205 0.74 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL13889496 0.74 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1MAPK1RETKDR
SCHEMBL12601699 0.74 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1MAPK1RETKDR

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-8431366-B2 Modified oligonucleotides and applications thereof APPLIED BIOSYSTEMS, LLC (US) 2013-04-30 — — US disclosed
US-20110287431-A1 MODIFIED OLIGONUCLEOTIDES AND APPLICATIONS THEREOF Life Technologies Corporation (US) 2011-11-24 — — US disclosed
Send feedback