SCHEMBL6977361

SCHEMBL6977361

CCC(=O)Oc1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
MAPT P10636 2/20 0.65
KMT2A Q03164 6/20 0.63
HSD17B10 Q99714 3/20 0.63
MEN1 O00255 3/20 0.63
ALDH1A1 P00352 4/20 0.60
TDP1 Q9NUW8 3/20 0.60
HPGD P15428 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
POLB P06746 2/20 0.57
APEX1 P27695 1/20 0.57
NPC1 O15118 1/20 0.53
CYP1A2 P05177 1/20 0.51

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
SCHEMBL8298007 0.84 RAB9A (0.79) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL11456649 0.81 RAB9A (0.68) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL15923472 0.81 RAB9A (0.72) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL10050510 0.80 RAB9A (0.85) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL5631833 0.80 RAB9A (0.77) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL7299163 0.80 RAB9A (1.00) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL9798847 0.80 GAA (0.64) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL4903484 0.79 RAB9A (0.65) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL16718938 0.79 RAB9A (0.65) RAB9ASMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL11000826 0.79 ALDH1A1 (0.63) RAB9ASMN1; SMN2KMT2AHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1208092-A4 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO LTD (KR) 2003-01-02 EP disclosed
EP-1208092-A1 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO., LTD. (KR) 2002-05-29 EP disclosed
WO-2001077092-A1 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO., LTD. (KR) 2001-10-18 WO disclosed