SCHEMBL6939614

SCHEMBL6939614

Cc1cccc(C)c1NC(=O)Nc1ccccc1Sc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDX3X O00571 1/20 0.51
MAPT P10636 7/20 0.50
ALDH1A1 P00352 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
LMNA P02545 4/20 0.47
HTT P42858 3/20 0.47
RORC P51449 1/20 0.45
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
MAPK1 P28482 2/20 0.43
HPGD P15428 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TRPV1 Q8NER1 1/20 0.42

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
SCHEMBL6941536 0.92 DDX3X (0.57) DDX3XMAPTALDH1A1L3MBTL1LMNA
SCHEMBL6941248 0.86 MAPT (0.50) MAPTALDH1A1L3MBTL1LMNAHTT
SCHEMBL6937553 0.86 MAPT (0.47) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL6941597 0.84 MAPT (0.57) DDX3XMAPTALDH1A1L3MBTL1LMNA
SCHEMBL6939390 0.84 MEN1 (0.60) MAPTALDH1A1LMNAHTTMEN1
SCHEMBL6936818 0.84 MEN1 (0.54) DDX3XMAPTALDH1A1L3MBTL1LMNA
SCHEMBL6939617 0.83 KMT2A (0.60) DDX3XMAPTALDH1A1LMNAHTT
SCHEMBL6940824 0.83 L3MBTL1 (0.52) DDX3XMAPTALDH1A1L3MBTL1LMNA
SCHEMBL6937543 0.83 DDX3X (0.50) DDX3XMAPTALDH1A1L3MBTL1LMNA
SCHEMBL6944030 0.82 ALOX5 (0.53) MAPTALDH1A1LMNAHTTRORC

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