SCHEMBL28670102

SCHEMBL28670102

CC(C)(C)OC(=O)N1CCOCC1C(=O)NC1(c2ccc(F)c(C(F)(F)F)c2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.37
F2 P00734 2/20 0.37
F9 P00740 2/20 0.37
F10 P00742 2/20 0.37
F12 P00748 2/20 0.37
PRSS1 P07477 2/20 0.37
PRSS2 P07478 2/20 0.37
F7 P08709 2/20 0.37
PRSS3 P35030 2/20 0.37
ALDH1A1 P00352 1/20 0.36
LGMN Q99538 1/20 0.35
IL1B P01584 1/20 0.35
P2RX7 Q99572 1/20 0.35
PDE2A O00408 2/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
PTGER4 P35408 1/20 0.34
PREP P48147 1/20 0.34

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
SCHEMBL28670100 1.00 KCNN4 (0.37) KCNN4F2F9F10F12
SCHEMBL29262043 0.88 ALDH1A1 (0.42) KCNN4ALDH1A1PDE2ALMNANPSR1
SCHEMBL22470105 0.88 ALDH1A1 (0.42) KCNN4ALDH1A1PDE2ALMNANPSR1
SCHEMBL22470470 0.87 F2 (0.38) KCNN4F2F9F10F12
SCHEMBL22470473 0.87 F2 (0.38) KCNN4F2F9F10F12
SCHEMBL29261962 0.83 IL1B (0.42) KCNN4IL1BP2RX7NR1H2NR1H3
SCHEMBL29261963 0.83 IL1B (0.42) KCNN4IL1BP2RX7NR1H2NR1H3
SCHEMBL29355246 0.83 IL1B (0.42) KCNN4IL1BP2RX7NR1H2NR1H3
SCHEMBL30823530 0.81 NPC1 (0.40) ALDH1A1LGMNIL1BP2RX7LMNA
SCHEMBL22470118 0.76 KCNN4 (0.42) KCNN4ALDH1A1PDE2ALMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113631538-B Novel potassium channel inhibitors 萨尼奥纳有限责任公司 2024-05-31 CN disclosed
CN-113631538-A Novel potassium channel inhibitors 萨尼奥纳有限责任公司 2021-11-09 CN disclosed