SCHEMBL6160787

SCHEMBL6160787

NC(=O)c1cccc(CC(=O)NO)c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 4/20 0.66
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
HDAC8 Q9BY41 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
PARP1 P09874 5/20 0.50
MEP1A Q16819 1/20 0.48
FOLH1 Q04609 1/20 0.46
KDM1A O60341 1/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
MAPK8 P45983 1/20 0.45
F10 P00742 1/20 0.45
PLA2G10 O15496 1/20 0.44
PLA2G2A P14555 1/20 0.44
SHMT1 P34896 1/20 0.44

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
SCHEMBL3054667 0.82 PARP1 (0.53) MEP1BPARP1FOLH1KDM1AMAOA
SCHEMBL2426602 0.80 AKR1B1 (0.54) MEP1BPARP1FOLH1PLA2G10PLA2G2A
SCHEMBL19510176 0.80 MEP1B (1.00) MEP1BMEP1A
SCHEMBL6160793 0.79 HDAC8 (0.60) MEN1KMT2AHDAC8HDAC6MAOA
SCHEMBL3048724 0.79 PARP1 (0.53) MEP1BPARP1FOLH1F10
SCHEMBL6030006 0.79 HTR3E (0.58) MEP1BPARP1FOLH1F10
SCHEMBL9405490 0.79 PARP1 (0.53) MEP1BPARP1FOLH1KDM1AMAOA
SCHEMBL2635907 0.78 HDAC6 (0.59) MEP1BMEN1KMT2AHDAC8HDAC6
SCHEMBL24031215 0.78 SLC7A5 (0.56) MEP1BPARP1F10
SCHEMBL3451761 0.78 SLC7A5 (0.56) MEP1BPARP1F10

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