SCHEMBL29068544

SCHEMBL29068544

CS(=O)(=O)CCCOc1[c]cccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNJ5 P48544 1/20 0.36
KCNJ3 P48549 1/20 0.36
FFAR1 O14842 4/20 0.32
KCNH2 Q12809 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
SCHEMBL2971835 0.79 LTA4H (0.38) KCNH2
SCHEMBL28489132 0.78 SMN1; SMN2 (0.38) KCNH2
SCHEMBL2968624 0.77 NPC1 (0.38) KCNH2
SCHEMBL23652 0.74 NFE2L2 (0.33)
SCHEMBL2974066 0.73 L3MBTL1 (0.37) KCNH2
SCHEMBL27997690 0.73 FFAR1 (0.33) FFAR1
SCHEMBL28473733 0.73 MKNK1 (0.32) FFAR1KCNH2
SCHEMBL9723567 0.70 L3MBTL1 (0.31)
SCHEMBL2105809 0.70 EPHX2 (0.36)
SCHEMBL29068556 0.70 FFAR1 (0.36) KCNJ5KCNJ3FFAR1KCNH2

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
CN-116745289-A Agonists of free fatty acid receptor 1 and their use in diseases associated with said receptor 奥洛治疗有限公司 2023-09-12 CN disclosed