SCHEMBL7417510

SCHEMBL7417510

CCC[C@H](NOC1CCCCO1)C(CC1CCCCC1)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.33
CTSL P07711 2/20 0.33
CTSB P07858 2/20 0.33
CTSH P09668 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CTSS P25774 1/20 0.31
LTA4H P09960 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30
METAP2 P50579 1/20 0.30
CPB2 Q96IY4 2/20 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
SCHEMBL7385867 1.00 CTSK (0.33) CTSKCTSLCTSBCTSHSMN1; SMN2
SCHEMBL7383410 1.00 CTSK (0.33) CTSKCTSLCTSBCTSHSMN1; SMN2
SCHEMBL7381198 0.91 CTSL (0.34) CTSKCTSLCTSBCTSHKMT2A
SCHEMBL7421314 0.91 CTSL (0.34) CTSKCTSLCTSBCTSHKMT2A
SCHEMBL7380103 0.85 MEN1 (0.32) SMN1; SMN2KMT2AMEN1ALDH1A1MMP1
SCHEMBL7380889 0.85 MEN1 (0.32) SMN1; SMN2KMT2AMEN1ALDH1A1MMP1
SCHEMBL7410645 0.85 MEN1 (0.32) SMN1; SMN2KMT2AMEN1ALDH1A1MMP1
SCHEMBL7418375 0.83 MEN1 (0.31) SMN1; SMN2KMT2AMEN1
SCHEMBL7472659 0.83 MEN1 (0.31) SMN1; SMN2KMT2AMEN1
SCHEMBL7423731 0.78 MGLL (0.39) SMN1; SMN2KMT2AMEN1MMP2MMP3

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