SCHEMBL7380240

SCHEMBL7380240

COc1c(F)cc(C=O)c(F)c1O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 18/20 0.47
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TRIM24 O15164 1/20 0.41
TYR P14679 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41
TLR2 O60603 1/20 0.41
TLR1 Q15399 1/20 0.41
TLR6 Q9Y2C9 1/20 0.41

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
SCHEMBL28678695 0.85 ERN1 (0.51) ERN1CA1CA2
SCHEMBL29365717 0.85 ERN1 (0.51) ERN1CA1CA2
SCHEMBL9787541 0.85 ERN1 (0.48) ERN1CA1CA2TRIM24TYR
SCHEMBL4655024 0.82 ALDH1A1 (0.42) ERN1CA1CA2TRIM24TYR
SCHEMBL27189181 0.82 ALDH1A1 (0.42) ERN1CA1CA2TRIM24TYR
SCHEMBL27189236 0.82 ERN1 (0.47) ERN1CA1CA2TRIM24TYR
SCHEMBL29933143 0.81 ERN1 (0.48) ERN1CA1CA2TRIM24TYR
SCHEMBL28915744 0.81 ERN1 (0.48) ERN1CA1CA2TRIM24TYR
SCHEMBL5759448 0.79 PRKDC (0.44) ERN1CA1CA2TRIM24TYR
SCHEMBL310426 0.79 ALDH1A1 (0.42) ERN1CA1CA2TRIM24TYR

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
CN-102731378-A Preparation method of 3-hydroxyl-N-(3,5-dichloropyridine-4-group)-4-(difluoromethoxy)benzamide SICHUAN SHUZHONG PHARMACEUTICAL CO LTD 2012-10-17 CN disclosed
EP-0934280-A1 PDE IV INHIBITING 2-CYANOIMINOIMIDAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1999-08-11 EP disclosed
WO-1998014432-A1 PDE IV INHIBITING 2-CYANOIMINOIMIDAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1998-04-09 WO disclosed