SCHEMBL6991932

SCHEMBL6991932

Nc1ccc(CN(Cc2ccc(N)cc2)C(=O)c2ccnc(C(=O)N(Cc3ccc(N)cc3)Cc3ccc(N)cc3)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
ALDH1A1 P00352 2/20 0.41
CFTR P13569 1/20 0.40
CYP3A4 P08684 2/20 0.40
PI4KB Q9UBF8 1/20 0.40
KDM4E B2RXH2 2/20 0.39
KDM4C Q9H3R0 2/20 0.39
KDM6B O15054 1/20 0.39
TET3 O43151 1/20 0.39
KDM4A O75164 1/20 0.39
BBOX1 O75936 1/20 0.39
KDM5A P29375 1/20 0.39
KDM5C P41229 1/20 0.39
ASPH Q12797 1/20 0.39
KDM4D Q6B0I6 1/20 0.39
TET2 Q6N021 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
KDM7A Q6ZMT4 1/20 0.39
KDM8 Q8N371 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
SCHEMBL6992829 0.86 MAPT (0.46) MAPTL3MBTL1ALDH1A1CFTRKDM4E
SCHEMBL6991899 0.86 MAPT (0.51) MAPTL3MBTL1ALDH1A1CFTRKDM4E
SCHEMBL6238400 0.85 SLC2A1 (0.46) MAPTL3MBTL1ALDH1A1CFTRKDM4E
SCHEMBL5210605 0.85 CFTR (0.55) MAPTL3MBTL1ALDH1A1CFTRKDM4E
SCHEMBL6990533 0.82 SLC2A1 (0.53) MAPTALDH1A1KMT2AMEN1SLC2A1
SCHEMBL5210601 0.78 KDM4E (0.56) MAPTL3MBTL1ALDH1A1CFTRKDM4E
SCHEMBL6987913 0.78 KDM4E (0.48) L3MBTL1ALDH1A1CFTRKDM4EKMT2A
SCHEMBL5215161 0.78 USP2 (0.53) MAPTL3MBTL1ALDH1A1CYP3A4KDM4E
SCHEMBL5214358 0.78 PPARG (0.55) MAPTL3MBTL1ALDH1A1CFTRKMT2A
SCHEMBL6238397 0.77 ALDH1A1 (0.54) MAPTL3MBTL1ALDH1A1CFTRKDM4E

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-1362033-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP claimed
WO-2002064568-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed