SCHEMBL16631827

SCHEMBL16631827

CC#Cc1[nH]c(=O)ccc1[C@@H]1O[C@H](CO)C(OC)[C@@H]1F

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.33
PAX8 Q06710 1/20 0.33
PRKCA P17252 2/20 0.31
SLC5A2 P31639 2/20 0.31
PRKD3 O94806 1/20 0.30
PRKCG P05129 1/20 0.30
PRKCB P05771 1/20 0.30
PRKCH P24723 1/20 0.30
PRKCI P41743 1/20 0.30
PRKCE Q02156 1/20 0.30
PRKCQ Q04759 1/20 0.30
PRKCZ Q05513 1/20 0.30
PRKCD Q05655 1/20 0.30
PRKD1 Q15139 1/20 0.30

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
SCHEMBL16631510 0.86 SLC5A2 (0.36) DYRK1APAX8PRKCASLC5A2PRKD3
SCHEMBL18079912 0.85 SLC28A3 (0.37) SLC5A2
SCHEMBL16631240 0.79 SLC28A1 (0.41) SLC5A2
SCHEMBL16631848 0.75
SCHEMBL16631572 0.73 SLC5A2 (0.37) DYRK1APAX8PRKCASLC5A2
SCHEMBL16631173 0.71 SLC28A1 (0.38) SLC5A2
SCHEMBL18079981 0.71 P2RY2 (0.47)
SCHEMBL16631218 0.70 LGALS3 (0.35) SLC5A2
SCHEMBL16631379 0.69 SLC28A3 (0.38) SLC5A2
SCHEMBL16631232 0.69 TK2 (0.35) SLC5A2

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
WO-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed