SCHEMBL7976923

SCHEMBL7976923

CNC(=O)COc1cccc(CCNC(=O)/C=C/c2cccnc2)c1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 15/20 0.50
HDAC3 O15379 2/20 0.49
NCOR2 Q9Y618 2/20 0.49
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
PTGS2 P35354 1/20 0.48
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 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
SCHEMBL7976924 1.00 NAMPT (0.50) NAMPTHDAC3NCOR2LMNAHPGD
SCHEMBL6166592 0.89 NAMPT (0.54) NAMPTHDAC3LMNAHPGDHTT
SCHEMBL6166590 0.89 NAMPT (0.54) NAMPTHDAC3LMNAHPGDHTT
SCHEMBL6168462 0.85 ALDH1A1 (0.60) NAMPTLMNAHPGDMMP1MMP2
SCHEMBL6168453 0.85 ALDH1A1 (0.60) NAMPTLMNAHPGDMMP1MMP2
SCHEMBL7994516 0.84 NAMPT (0.53) NAMPTHDAC3NCOR2LMNAHPGD
SCHEMBL7994511 0.84 NAMPT (0.53) NAMPTHDAC3NCOR2LMNAHPGD
SCHEMBL7991010 0.82 NAMPT (0.51) NAMPTHDAC3NCOR2LMNAHPGD
SCHEMBL7991014 0.82 NAMPT (0.51) NAMPTHDAC3NCOR2LMNAHPGD
SCHEMBL6167752 0.80 MMP1 (0.67) NAMPTHDAC3NCOR2MMP1MMP2

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
US-6313153-B1 ADMINISTERING PYRIDYLACRYLAMIDE COMPOUND FOR THERAPY OF NEPHRITIS TSUMURA & CO. (JP) 2001-11-06 US disclosed
EP-1000935-A1 PYRIDYLACRYLAMIDE DERIVATIVES AND NEPHRITIS REMEDIES AND TGF-$g(b) INHIBITORS CONTAINING THE SAME TSUMURA & CO. (JP) 2000-05-17 EP disclosed