SCHEMBL10746476

SCHEMBL10746476

CC(C)S(=O)(=O)c1cccc(O)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.31
TXNRD1 Q16881 1/20 0.31
PTGS1 P23219 2/20 0.31
PTGS2 P35354 1/20 0.31
LMNA P02545 2/20 0.30
FAAH O00519 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
GABRA1 P14867 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
GABRB1 P18505 1/20 0.30
GABRG2 P18507 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2C P28335 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 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
SCHEMBL12780354 0.78 SLC40A1 (0.42) HPGDKDM4E
SCHEMBL10745662 0.72 TXNRD1 (0.34) TXNRD1
SCHEMBL819454 0.68 KDM4E (0.46) TXNRD1CYP1A2CYP3A4TSHRSLC6A2
SCHEMBL11630594 0.67 TXNRD1 (0.52) TXNRD1PTGS2LMNACA1CA2
SCHEMBL3606195 0.65 POLB (0.44) LMNACA1CA2POLB
SCHEMBL128525 0.65
SCHEMBL30602373 0.65 TXNRD1 (0.37) TXNRD1
SCHEMBL29131001 0.65 TXNRD1 (0.37) TXNRD1
SCHEMBL4752882 0.64 GABRA1 (0.41) PTGS1LMNAFAAHCA1CA2
SCHEMBL19951522 0.64 EDNRA (0.33) TXNRD1LMNA

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
US-4652574-A Certain mono-, di- or tri-substituted pyridyl esters of alkane sulfonic acids having insecticidal, acaricidal and nematocidal properties NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1987-03-24 US disclosed
EP-0182603-A2 Alkanesulfonate derivatives useful as an insecticide, acaricide and nematicide NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1986-05-28 EP disclosed