SCHEMBL5672196

SCHEMBL5672196

Cc1nc(Cl)c(C=CC(=O)NS(=O)(=O)C=Cc2ccccc2)n1Cc1ccc(OCC2CCCCC2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
SLC16A3 O15427 3/20 0.36
SLC16A1 P53985 3/20 0.36
MCTS1 Q9ULC4 3/20 0.36
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
ALOX5AP P20292 1/20 0.34
APP P05067 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
DYRK1A Q13627 2/20 0.33
ACACB O00763 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HSP90AA1 P07900 2/20 0.33
S1PR1 P21453 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
SCHEMBL5672192 1.00 BCL2L1 (0.36) BCL2L1MCL1SLC16A3SLC16A1MCTS1
SCHEMBL5672195 1.00 BCL2L1 (0.36) BCL2L1MCL1SLC16A3SLC16A1MCTS1
SCHEMBL5675543 0.99 SLC16A3 (0.36) BCL2L1MCL1SLC16A3SLC16A1MCTS1
SCHEMBL5675536 0.99 SLC16A3 (0.36) BCL2L1MCL1SLC16A3SLC16A1MCTS1
SCHEMBL5675545 0.99 SLC16A3 (0.36) BCL2L1MCL1SLC16A3SLC16A1MCTS1
SCHEMBL5673941 0.87 HDAC8 (0.39) MCL1ALDH1A1PTGDR2APPHDAC1
SCHEMBL5672554 0.87 S1PR1 (0.43) ALDH1A1PTGDR2APPHDAC1HDAC2
SCHEMBL5673937 0.87 HDAC8 (0.39) MCL1ALDH1A1PTGDR2APPHDAC1
SCHEMBL5672552 0.87 S1PR1 (0.43) ALDH1A1PTGDR2APPHDAC1HDAC2
SCHEMBL5672936 0.86 BCL2L1 (0.44) BCL2L1MCL1ALOX5APPTGER3

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
EP-1142879-A1 IMIDAZOLE COMPOUNDS AND MEDICINAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP claimed
US-7060721-B1 Imidazole compounds and medicinal use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2006-06-13 US disclosed
EP-1142879-A1 IMIDAZOLE COMPOUNDS AND MEDICINAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed