SCHEMBL6159253

SCHEMBL6159253

NC(=O)c1cccc(C(=O)NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.63
PTGS1 P23219 2/20 0.63
MEN1 O00255 1/20 0.60
LMNA P02545 1/20 0.60
KMT2A Q03164 1/20 0.60
FLT1 P17948 3/20 0.56
FLT4 P35916 3/20 0.56
KDR P35968 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MCL1 Q07820 4/20 0.56
BCL2L1 Q07817 3/20 0.56
P4HTM Q9NXG6 3/20 0.52
EGFR P00533 1/20 0.52
KAT6A Q92794 3/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
GAA P10253 1/20 0.50
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL6161386 0.91 MEN1 (0.60) PTGS2PTGS1MEN1LMNAKMT2A
SCHEMBL10762954 0.87 PTGS2 (0.67) PTGS2PTGS1MEN1LMNAKMT2A
SCHEMBL12489988 0.85 MEN1 (0.66) PTGS2PTGS1MEN1LMNAKMT2A
SCHEMBL6159257 0.84 MEN1 (0.69) PTGS2PTGS1MEN1LMNAKMT2A
SCHEMBL376340 0.84 MEN1 (0.73) PTGS2PTGS1MEN1LMNAKMT2A
Hydrochloric Acid SCHEMBL8303230 0.83 MEN1 (0.68) PTGS2PTGS1MEN1LMNAKMT2A
SCHEMBL174010 0.83 FLT1 (0.77) PTGS2PTGS1MEN1LMNAKMT2A
Potassium SCHEMBL30358590 0.81 FLT1 (0.74) PTGS2PTGS1MEN1LMNAKMT2A
SCHEMBL29011132 0.81 FLT1 (0.74) PTGS2PTGS1MEN1LMNAKMT2A
SCHEMBL9179058 0.81 KAT6A (0.74) PTGS2PTGS1MEN1LMNAKMT2A

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-1178969-B1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2005-07-13 EP disclosed
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed
EP-1178969-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2002-02-13 EP disclosed
WO-2000027823-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-18 WO disclosed