SCHEMBL7359606

SCHEMBL7359606

CC1(C)C(=O)NC1c1ccc2ccccc2c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.39
SLC6A4 P31645 5/20 0.39
SLC6A2 P23975 5/20 0.38
SLC6A3 Q01959 4/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
PTGER3 P43115 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GRIA3 P42263 1/20 0.37
GRIA4 P48058 1/20 0.37
KDM4E B2RXH2 2/20 0.37
CYP2D6 P10635 1/20 0.36
KCNH2 Q12809 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL7358825 0.78 MAPT (0.49) MEN1KMT2AKDM4EMAPTL3MBTL1
SCHEMBL28843433 0.76 PTGER3 (0.39) MMP13SLC6A4SLC6A2SLC6A3CTDSP1
SCHEMBL28843435 0.76 PTGER3 (0.39) MMP13SLC6A4SLC6A2SLC6A3CTDSP1
SCHEMBL7364109 0.73 MAPT (0.48) SLC6A2SLC6A3MEN1KMT2AMAPT
SCHEMBL14143061 0.73 TSHR (0.51) MEN1KMT2AKDM4EMAPTL3MBTL1
SCHEMBL31668447 0.72 POLB (0.42) MEN1KMT2ACYP2D6MAPK1
SCHEMBL7354999 0.72 KMT2A (0.51) KMT2A
SCHEMBL24017025 0.69 MMP13 (0.43) MMP13SLC6A4SLC6A2SLC6A3CTDSP1
SCHEMBL2829814 0.68 TDP1 (0.54) MMP13SLC6A4SLC6A2SLC6A3CTDSP1
SCHEMBL8187820 0.66 MAPT (0.55) MEN1KMT2AGRIA3GRIA4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0800516-B1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED (b)-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORP (JP) 2001-09-19 EP disclosed
US-5866592-A Fibrinogen receptor antagonist and pharmaceutical compositions comprising the same NIPPON STEEL CORPORATION (JP) 1999-02-02 US disclosed
EP-0800516-A1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED (b)-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORPORATION (JP) 1997-10-15 EP disclosed
WO-1996020172-A1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED β-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORPORATION (JP) 1996-07-04 WO disclosed