SCHEMBL7799710

SCHEMBL7799710

CON(C)C(=O)C(CCNC(=O)CC(C)CCNC(=O)OCc1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.42
SLC1A1 P43005 1/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FOLH1 Q04609 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
KCNA5 P22460 2/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 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
SCHEMBL6468352 0.91 LMNA (0.50) SLC1A3SLC1A1LMNASMN1; SMN2FOLH1
SCHEMBL22982284 0.80 MEN1 (0.47) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL5172763 0.80 MEN1 (0.47) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL7044864 0.79 SLC1A3 (0.41) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL6465943 0.79 ANPEP (0.44) SLC1A3SLC1A1LMNASMN1; SMN2FOLH1
SCHEMBL7790161 0.79 LMNA (0.46) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL7046317 0.78 SLC1A3 (0.39) SLC1A3SLC1A1LMNASMN1; SMN2FOLH1
SCHEMBL6181962 0.78 CTSS (0.50) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL6062401 0.77 L3MBTL1 (0.40) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL6063445 0.77 PTGER4 (0.47) SLC1A3SLC1A1LMNASMN1; SMN2L3MBTL1

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-1159260-A1 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2001-12-05 EP disclosed
WO-2000055124-A2 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2000-09-21 WO disclosed