SCHEMBL6940372

SCHEMBL6940372

Cc1cccc(C)c1NC(=O)Nc1ccccc1Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.53
GAA P10253 2/20 0.52
MEN1 O00255 6/20 0.52
KMT2A Q03164 6/20 0.52
DDX3X O00571 1/20 0.51
LMNA P02545 4/20 0.50
MAPK1 P28482 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
MYOC Q99972 1/20 0.50
PPIA P62937 1/20 0.49
HTT P42858 3/20 0.47
PYGL P06737 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
SCHEMBL8104860 0.92 DDX3X (0.57) MAPTGAAMEN1KMT2ADDX3X
SCHEMBL6937552 0.86 ATM (0.54) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL6939752 0.86 MAPT (0.58) MAPTGAAMEN1KMT2ALMNA
SCHEMBL6939932 0.85 LPAR1 (0.62) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL7622067 0.84 MAPT (0.57) MAPTMEN1KMT2ADDX3XLMNA
SCHEMBL7623586 0.84 MAPT (0.64) MAPTGAAMEN1KMT2ALMNA
SCHEMBL7070334 0.83 GAA (0.56) MAPTGAAMEN1KMT2ADDX3X
SCHEMBL8103094 0.83 KMT2A (0.74) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL7626118 0.83 MAPT (0.55) MAPTMEN1KMT2ADDX3XLMNA
SCHEMBL6941701 0.82 ATM (0.63) MAPTMEN1KMT2ALMNAMAPK1

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-1042278-B1 1,3-DISUBSTITUTED UREAS AS ACAT INHIBITORS, AND METHOD OF PREPARING THEREOF SLOVAKOFARMA AS (SK) 2003-03-05 EP disclosed
US-6444691-B1 ANTICHOLESTEROL AGENTS SOLVAKOFARMA, A.S. (SK) 2002-09-03 US disclosed
EP-1042278-A1 1,3-DISUBSTITUTED UREAS AS ACAT INHIBITORS, AND METHOD OF PREPARING THEREOF Slovakofarma, A.S. (SK) 2000-10-11 EP disclosed
WO-1999032437-A1 1,3-DISUBSTITUTED UREAS AS ACAT INHIBITORS, AND METHOD OF PREPARING THEREOF SLOVAKOFARMA, A.S. (SK) 1999-07-01 WO disclosed