SCHEMBL7559138

SCHEMBL7559138

CCCCOc1c2cc(=O)c(OCCC)cc-2cn(CC(C)(C)C)c1N(C)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.35
SLC6A5 Q9Y345 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
SCHEMBL7004682 0.95 SLC6A5 (0.32) FFAR4SLC6A5
SCHEMBL7004588 0.93 SLC6A5 (0.38) FFAR4SLC6A5
SCHEMBL7002021 0.90 NR1H4 (0.33) FFAR4
SCHEMBL7006105 0.89 SLC6A5 (0.33) SLC6A5
SCHEMBL7007513 0.89 THRA (0.32) FFAR4SLC6A5
SCHEMBL7554822 0.84 FFAR4 (0.32) FFAR4SLC6A5
SCHEMBL7554918 0.77 SLC6A5 (0.39) SLC6A5
SCHEMBL5239328 0.76 CNR2 (0.36) SLC6A5
SCHEMBL7002285 0.73 MCL1 (0.38) FFAR4
SCHEMBL7006171 0.69 ESR1 (0.34) FFAR4SLC6A5

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-2002062764-A9 FUSED HETEROCYCLIC COMPOUNDS TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-10-10 WO disclosed