SCHEMBL27677299

SCHEMBL27677299

CCc1c(C(=O)O)cc(C)c(Cl)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
GAA P10253 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MCL1 Q07820 3/20 0.38
CLCN2 P51788 3/20 0.37
HMGB1 P09429 1/20 0.37
CXCL12 P48061 1/20 0.37
BCL2L1 Q07817 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
AKR1B10 O60218 1/20 0.36
ABCB11 O95342 1/20 0.36
TTR P02766 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36
FABP2 P12104 1/20 0.36
RXRA P19793 1/20 0.36
TBXA2R P21731 1/20 0.36
NR4A1 P22736 1/20 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
SCHEMBL27677228 0.83 RARB (0.47) MCL1BCL2L1AKR1C2AKR1C1
SCHEMBL7050926 0.81 HMGB1 (0.49) KDM4EGAAHPGDHSD17B10MCL1
SCHEMBL11572090 0.80 KDM4E (0.36) KDM4EGAAHPGDHSD17B10MCL1
SCHEMBL27405084 0.80 KDM4E (0.44) KDM4EGAAHPGDHSD17B10MCL1
SCHEMBL2536655 0.80 KDM4E (0.50) KDM4EGAAHPGDHSD17B10HMGB1
SCHEMBL27412755 0.79 KDM4E (0.42) KDM4EGAAHPGDHSD17B10HMGB1
SCHEMBL28732291 0.77 KDM4E (0.41) KDM4EGAAHPGDHSD17B10HMGB1
SCHEMBL6100123 0.77 ALDH1A1 (0.44) KDM4EGAAHPGDHSD17B10CLCN2
SCHEMBL28733611 0.77 KDM4E (0.41) KDM4EGAAHPGDHSD17B10HMGB1
SCHEMBL28733700 0.77 GABRP (0.41) KDM4EGAAHPGDHSD17B10CLCN2

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
CN-101018847-B Improvements in or relating to organic compositions RECKITT BENCKISER INC 2011-05-11 CN disclosed
CN-101018847-A Improvements in or relating to organic compositions RECKITT BENCKISER INC (US) 2007-08-15 CN disclosed