SCHEMBL27353040

SCHEMBL27353040

CCOC(=O)c1cc(OCC(C)NS(=O)(=O)C(F)(F)F)c(C)c2c1CCC2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.33
MAPT P10636 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ACHE P22303 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NLRP3 Q96P20 3/20 0.32
ADRB2 P07550 2/20 0.32
NMT2 O60551 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
NMT1 P30419 1/20 0.32
HPGD P15428 5/20 0.32
KDM4E B2RXH2 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
USP2 O75604 1/20 0.32
ATM Q13315 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 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
SCHEMBL30995622 0.90 RXRA (0.35) ALDH1A1NPSR1ADRB2ADRB1ADRB3
SCHEMBL27353047 0.90 RXRA (0.35) ALDH1A1NPSR1ADRB2ADRB1ADRB3
SCHEMBL27353054 0.89 L3MBTL1 (0.31) L3MBTL1NPSR1ADRB2ADRB1ADRB3
SCHEMBL30995659 0.89 L3MBTL1 (0.31) L3MBTL1NPSR1ADRB2ADRB1ADRB3
SCHEMBL27352983 0.81 CTSS (0.33) NPC1
SCHEMBL30995619 0.81 CTSS (0.33) NPC1
SCHEMBL27352992 0.81 CTSS (0.33) NPC1
SCHEMBL30995650 0.80 HSD17B1 (0.30)
SCHEMBL27353063 0.80 HSD17B1 (0.30)
SCHEMBL30995609 0.79 ALDH1A1 (0.42) ALDH1A1MAPTNPSR1ADRB2NMT2

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-2024126650-A1 NOVEL BICYCLIC-CARBOXAMIDE COMPOUNDS USEFUL AS PESTICIDES SYNGENTA CROP PROTECTION AG (CH) 2024-06-20 WO disclosed