SCHEMBL22779403

SCHEMBL22779403

OC(C(S)S)C1CCCN1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NOS2 P35228 2/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL25964107 0.86 HIF1A (0.37) HIF1AHSD17B10NOS2NOS3NOS1
SCHEMBL21090095 0.83 HIF1A (0.38) HIF1AHSD17B10NOS2NOS3NOS1
SCHEMBL18735919 0.83
SCHEMBL18464548 0.83 HIF1A (0.38) HIF1AHSD17B10NOS2NOS3NOS1
SCHEMBL25972536 0.79 SLC6A2 (0.39) HIF1AHSD17B10SLC6A2SLC6A4SLC6A3
SCHEMBL4360524 0.79 SLC6A2 (0.39) HIF1AHSD17B10SLC6A2SLC6A4SLC6A3
SCHEMBL19407944 0.79 HIF1A (0.36) HIF1AHSD17B10NOS2NOS3NOS1
SCHEMBL1132940 0.77
SCHEMBL4308213 0.77
SCHEMBL16165636 0.76 SLC6A3 (0.35) HIF1AHSD17B10NOS2NOS3NOS1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219516-A2 CHIRAL CONTROL Wave Life Sciences Ltd. (SG) 2023-08-02 EP disclosed
EP-2872147-B1 METHOD FOR MAKING CHIRAL OLIGONUCLEOTIDES WAVE LIFE SCIENCES LTD (SG) 2022-12-21 EP disclosed
EP-3812370-A1 ASYMMETRIC AUXILIARY GROUP Wave Life Sciences Ltd. (SG) 2021-04-28 EP disclosed
EP-2872485-B1 ASYMMETRIC AUXILIARY GROUP WAVE LIFE SCIENCES LTD (SG) 2020-12-16 EP disclosed