SCHEMBL7973699

SCHEMBL7973699

CS(=O)(=O)OC1COC(c2ccccc2)C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
CHRM2 P08172 10/20 0.40
CHRM3 P20309 7/20 0.40
CHRM1 P11229 6/20 0.40
CHRM4 P08173 5/20 0.40
CHRM5 P08912 8/20 0.39
MOGAT2 Q3SYC2 1/20 0.34
ADRA2A P08913 3/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ADRA1A P35348 1/20 0.33
CYP19A1 P11511 1/20 0.33

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
SCHEMBL1267155 0.85 TSHR (0.38) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL1267152 0.85 TSHR (0.38) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL17158486 0.85 GSTO1 (0.37) CHRM2CHRM3CHRM5
SCHEMBL17815875 0.81 MEN1 (0.42) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL5208182 0.81 MEN1 (0.42) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL13275669 0.76 L3MBTL1 (0.44) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL20925575 0.76 L3MBTL1 (0.44) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL15615606 0.76 L3MBTL1 (0.44) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL16934616 0.76 L3MBTL1 (0.44) TSHRCHRM2CHRM3CHRM1CHRM4
SCHEMBL31586083 0.75 HCRTR2 (0.40) KDM4EMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207668-B1 FOR CONTROLLING INSECTS OR THEIR EGGS; AS FUNGICIDES, OVICIDES OR AS VETERINARY MEDICAMENTS HOECHST SCHERING (DE) 2001-03-27 US disclosed
EP-0892798-A1 SUBSTITUTED PYRIDINES/PYRIMIDINES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF AS PESTICIDES Hoechst Schering AgrEvo GmbH (DE) 1999-01-27 EP disclosed
WO-1997037991-A1 SUBSTITUTED PYRIDINES/PYRIMIDINES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF AS PESTICIDES HOECHST SCHERING AGREVO GMBH (DE) 1997-10-16 WO disclosed