SCHEMBL7363823

SCHEMBL7363823

CC(C)SCCNC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
HTT P42858 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.53
MAPT P10636 1/20 0.52
TGM2 P21980 1/20 0.51
SLC1A3 P43003 1/20 0.51
SLC1A1 P43005 1/20 0.51
KEAP1 Q14145 2/20 0.50
NFE2L2 Q16236 2/20 0.50
ATM Q13315 1/20 0.48
CTSL P07711 1/20 0.47
CTSS P25774 1/20 0.47

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
SCHEMBL7437779 0.81 LMNA (0.66) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL13055383 0.81 LMNA (0.80) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL16404734 0.81 LMNA (0.65) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL7378562 0.81 LMNA (0.65) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL18732911 0.81 LMNA (0.65) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL19145580 0.79 SMN1; SMN2 (0.68) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL19750475 0.79 LMNA (0.63) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL26630558 0.79 LMNA (0.63) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL8247523 0.79 LMNA (0.63) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL966270 0.79 LMNA (0.63) LMNASMN1; SMN2HTTL3MBTL1MAPT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1121118-A4 FORMAMIDES AS THERAPEUTIC AGENTS GLAXO GROUP LTD (GB) 2002-09-11 EP claimed
EP-1121118-A1 FORMAMIDES AS THERAPEUTIC AGENTS GLAXO GROUP LIMITED (GB) 2001-08-08 EP claimed
US-6172064-B1 METALLOPROTEASE INHIBITOR; ANTIARTHRITIC AGENTS, ANTIDIABETIC AGENTS; ANTITUMOR AGENTS GLAXO WELLCOME INC. 2001-01-09 US claimed
WO-2000012083-A1 FORMAMIDES AS THERAPEUTIC AGENTS GLAXO GROUP LIMITED (GB) 2000-03-09 WO claimed
WO-2000012082-A1 FORMAMIDE COMPOUNDS AS THERAPEUTIC AGENTS GLAXO GROUP LIMITED (GB) 2000-03-09 WO claimed
US-6329400-B1 INHIBITION OR ANTAGONISM OF MATRIX METALLOPROTEASES, AND/OR TUMOR NECROSIS FACTOR-ALPHA; EXTRACELLULAR MATRIX DEGRADATION, INHIBITION OF SHEDDING OF CELL SURFACE PROTEIN ECTODOMAINS AND CD23 PROTEOLYSIS GLAXO WELLCOME INC. 2001-12-11 US disclosed
US-6172064-B1 METALLOPROTEASE INHIBITOR; ANTIARTHRITIC AGENTS, ANTIDIABETIC AGENTS; ANTITUMOR AGENTS GLAXO WELLCOME INC. 2001-01-09 US disclosed
WO-2000012082-A1 FORMAMIDE COMPOUNDS AS THERAPEUTIC AGENTS GLAXO GROUP LIMITED (GB) 2000-03-09 WO disclosed