SCHEMBL6992829

SCHEMBL6992829

Cc1ccc(CN(Cc2ccc(C)cc2)C(=O)c2ccnc(C(=O)N(Cc3ccc(C)cc3)Cc3ccc(C)cc3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
SLC2A1 P11166 1/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TP53 P04637 2/20 0.44
OPRK1 P41145 1/20 0.43
LMNA P02545 1/20 0.42
KMT2A Q03164 3/20 0.42
MMP13 P45452 1/20 0.41
MEN1 O00255 2/20 0.40
ALKBH2 Q6NS38 1/20 0.40
ALKBH5 Q6P6C2 1/20 0.40
ALKBH3 Q96Q83 1/20 0.40
FTO Q9C0B1 1/20 0.40
CFTR P13569 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL6985934 0.86 MAPT (0.43) MAPTSLC2A1POLBL3MBTL1ALDH1A1
SCHEMBL6991899 0.86 MAPT (0.51) MAPTSLC2A1POLBL3MBTL1ALDH1A1
SCHEMBL6991932 0.86 MAPT (0.41) MAPTSLC2A1L3MBTL1ALDH1A1KMT2A
SCHEMBL5210605 0.85 CFTR (0.55) MAPTL3MBTL1ALDH1A1OPRK1KMT2A
SCHEMBL6238400 0.85 SLC2A1 (0.46) MAPTSLC2A1POLBL3MBTL1ALDH1A1
SCHEMBL6990533 0.85 SLC2A1 (0.53) MAPTSLC2A1ALDH1A1KMT2AMEN1
SCHEMBL5214358 0.81 PPARG (0.55) MAPTL3MBTL1ALDH1A1TP53LMNA
SCHEMBL5215161 0.81 USP2 (0.53) MAPTSLC2A1POLBL3MBTL1ALDH1A1
SCHEMBL6985928 0.79 KDM5B (0.49) MAPTL3MBTL1ALDH1A1ALKBH2ALKBH5
SCHEMBL5808527 0.79 ALDH1A1 (0.69) MAPTL3MBTL1ALDH1A1LMNAKMT2A

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