SCHEMBL5746552

SCHEMBL5746552

COc1ccc(CC2Sc3cc(NCc4ccccc4)ccc3N(CC(=O)NO)C2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.45
PDE5A O76074 1/20 0.44
ACHE P22303 1/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
THRB P10828 1/20 0.42
TSHR P16473 1/20 0.41
FFAR1 O14842 1/20 0.41
HDAC6 Q9UBN7 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
HDAC1 Q13547 2/20 0.39
HCRTR1 O43613 1/20 0.39
MCL1 Q07820 1/20 0.39

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
SCHEMBL5746660 0.91 PPARG (0.48) HIF1APDE5AACHELMNAHTT
SCHEMBL5746821 0.85 LMNA (0.53) LMNAHTTTSHRHDAC6HDAC8
SCHEMBL6847542 0.84 BMP1 (0.40) LMNAHTTTSHRMEN1KMT2A
SCHEMBL5746559 0.84 PPARG (0.51) LMNAHTTTHRBTSHRHDAC6
SCHEMBL5745179 0.84 THRB (0.47) LMNAHTTTHRBTSHRMCL1
SCHEMBL5747698 0.83 PPARG (0.45) LMNAHTTTHRBSMN1; SMN2MCL1
SCHEMBL6841912 0.82 RAB9A (0.45) LMNAHTTTHRBTSHRSMN1; SMN2
SCHEMBL5745464 0.79 GAA (0.41) LMNAHTTTSHRHDAC6HDAC8
SCHEMBL6846303 0.79 GAA (0.49) LMNAHTTHDAC6HDAC8SMN1; SMN2
SCHEMBL6847051 0.78 PPARG (0.43) LMNAHTTTHRBTSHRHDAC6

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-1173427-B1 HYDROXAMIC ACID DERIVATIVE DAINIPPON SUMITOMO PHARMA CO (JP) 2006-04-05 EP disclosed
US-6713477-B1 1,4-BENZTHIAZINES OR BENZOXAZINES; MATRIX METALLOPROTEINASE INHIBITORS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-03-30 US disclosed
EP-1173427-A1 HYDROXAMIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-01-23 EP disclosed
WO-2000063197-A1 HYDROXAMIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-10-26 WO disclosed