SCHEMBL7104175

SCHEMBL7104175

Cc1c(O)cccc1/C=C/COC(=O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.38
TRPM8 Q7Z2W7 2/20 0.38
SMPD2 O60906 1/20 0.38
CHRM4 P08173 3/20 0.37
CHRM3 P20309 3/20 0.37
PTGIR P43119 4/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
NFKB1 P19838 1/20 0.37
CA4 P22748 1/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGER1 P34995 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
PTGDR Q13258 3/20 0.37
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36

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
SCHEMBL7109797 0.83 TRPM8 (0.42) MAOBTRPM8SMPD2PTGIRATM
SCHEMBL7107857 0.83 TRPM8 (0.42) MAOBTRPM8SMPD2PTGIRATM
SCHEMBL7109794 0.82 PTGIR (0.45) TRPM8PTGIRTDP1L3MBTL1PTGER1
SCHEMBL7105744 0.82 PTGIR (0.45) TRPM8PTGIRTDP1L3MBTL1PTGER1
SCHEMBL7107860 0.82 PTGIR (0.45) TRPM8PTGIRTDP1L3MBTL1PTGER1
SCHEMBL7104410 0.78 DDB1 (0.40) TRPM8PTGIRPTGER1PTGER3PTGDR
SCHEMBL7107759 0.75 MMP1 (0.47) MAOBTRPM8MMP1MMP2MMP9
SCHEMBL7106168 0.75 ATM (0.41) MAOBCHRM4CHRM3PTGIRCA1
SCHEMBL7107398 0.70 CYP4F2 (0.41) MAOBMMP1MMP2MMP9MMP12
SCHEMBL7653702 0.70 CYP4F2 (0.41) MAOBMMP1MMP2MMP9MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1013639-B1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit HOFFMANN LA ROCHE (CH) 2003-10-01 EP claimed
EP-1013639-A1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit F. HOFFMANN-LA ROCHE AG (CH) 2000-06-28 EP claimed
EP-1013639-B1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit HOFFMANN LA ROCHE (CH) 2003-10-01 EP disclosed
EP-1013639-A1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit F. HOFFMANN-LA ROCHE AG (CH) 2000-06-28 EP disclosed