SCHEMBL21277439

SCHEMBL21277439

O=c1ccn([C@H]2CC[C@@H](CCO)O2)c(=S)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC28A1 O00337 1/20 0.37
▸ SLC28A2 O43868 1/20 0.37
▸ SLC29A1 Q99808 1/20 0.37
▸ SLC28A3 Q9HAS3 1/20 0.37
▸ ABL1 P00519 1/20 0.36
▸ RIN1 Q13671 1/20 0.36
▸ P2RY14 Q15391 6/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ALB P02768 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ P2RY2 P41231 6/20 0.35
▸ P2RY4 P51582 4/20 0.35
▸ P2RY6 Q15077 6/20 0.35
▸ DUT P33316 2/20 0.32
▸ TK1 P04183 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
SCHEMBL21277493 1.00 SLC28A1 (0.37) SLC28A1SLC28A2SLC29A1SLC28A3ABL1
SCHEMBL23621966 0.90 ABL1 (0.45) SLC28A1SLC28A2SLC29A1SLC28A3ABL1
SCHEMBL21277456 0.87 SLC28A1 (0.47) SLC28A1SLC28A2SLC29A1SLC28A3ABL1
SCHEMBL21277453 0.87 SLC28A1 (0.47) SLC28A1SLC28A2SLC29A1SLC28A3ABL1
SCHEMBL21277443 0.82 P2RY6 (0.39) SLC28A1SLC28A2SLC29A1SLC28A3ABL1
SCHEMBL15810663 0.81 P2RY2 (0.42) ABL1RIN1P2RY14LMNAP2RY2
SCHEMBL21277437 0.79 TK1 (0.43) ALDH1A1LMNAALBTK1
SCHEMBL21277447 0.79 TK1 (0.43) ALDH1A1LMNAALBTK1
SCHEMBL21345095 0.76 P2RY2 (0.58) P2RY14P2RY2P2RY4P2RY6
SCHEMBL23254269 0.76 SLC28A1 (0.52) SLC28A1SLC28A2SLC29A1SLC28A3ABL1

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
EP-2931319-B1 MODIFIED NUCLEIC ACID MOLECULES AND USES THEREOF MODERNATX INC (US) 2019-08-21 — — EP disclosed
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