SCHEMBL7380889

SCHEMBL7380889

CCCC(NOC1CCCCO1)C(CC(C)C)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MMP1 P03956 2/20 0.32
MMP3 P08254 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
APP P05067 1/20 0.30
BCHE P06276 1/20 0.30

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
SCHEMBL7410645 1.00 MEN1 (0.32) MEN1KMT2AMMP1MMP3SMN1; SMN2
SCHEMBL7380103 1.00 MEN1 (0.32) MEN1KMT2AMMP1MMP3SMN1; SMN2
SCHEMBL7418375 0.91 MEN1 (0.31) MEN1KMT2ASMN1; SMN2
SCHEMBL7472659 0.91 MEN1 (0.31) MEN1KMT2ASMN1; SMN2
SCHEMBL7386458 0.91 MEN1 (0.33) MEN1KMT2A
SCHEMBL7382361 0.91 MEN1 (0.33) MEN1KMT2A
SCHEMBL7377470 0.89 MEN1 (0.31) MEN1KMT2A
SCHEMBL7467337 0.89 MEN1 (0.31) MEN1KMT2A
SCHEMBL7385867 0.85 CTSK (0.33) MEN1KMT2AMMP1MMP3SMN1; SMN2
SCHEMBL7383410 0.85 CTSK (0.33) MEN1KMT2AMMP1MMP3SMN1; SMN2

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
EP-1019386-A1 REVERSE HYDROXAMATE DERIVATIVES AS METALLOPROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-07-19 EP disclosed
WO-1998038179-A1 REVERSE HYDROXAMATE DERIVATIVES AS METALLOPROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-09-03 WO disclosed