SCHEMBL8009882

SCHEMBL8009882

N#CCCCCCCCCC(C#N)C(=O)C=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.32
EPAS1 Q99814 2/20 0.32
SLC1A2 P43004 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
SCHEMBL27993318 0.77 SLC1A2 (0.35) SLC1A2
SCHEMBL11125343 0.75 TSHR (0.37) SLC1A2
SCHEMBL5102224 0.74 TSHR (0.37) SLC1A2
SCHEMBL28678577 0.70 SLC1A2 (0.42) SLC1A2
SCHEMBL27817458 0.69 SLC1A2 (0.43) SLC1A2
SCHEMBL31337500 0.69 TSHR (0.31)
SCHEMBL13916558 0.69 KMT2A (0.43)
SCHEMBL11408179 0.69 GPR84 (0.37) SLC1A2
Bicarbonate SCHEMBL11744374 0.67 TSHR (0.43) HIF1AEPAS1SLC1A2
Ethylene SCHEMBL29091063 0.67 SLC1A2 (0.40) SLC1A2

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-2000032671-A1 PROCESS FOR THE PRODUCTION OF DIKETO DINITRILES AND POLYMERS DERIVED THEREFROM COGNIS CORPORATION (US) 2000-06-08 WO disclosed