SCHEMBL6941599

SCHEMBL6941599

Cc1ccc(NC(=O)Nc2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)c(C)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.62
MEN1 O00255 10/20 0.62
KMT2A Q03164 10/20 0.62
MAPK1 P28482 4/20 0.62
HTT P42858 6/20 0.60
LMNA P02545 6/20 0.60
SMN1; SMN2 Q16637 5/20 0.56
HPGD P15428 2/20 0.56
NPSR1 Q6W5P4 3/20 0.55
ALDH1A1 P00352 3/20 0.55
MYOC Q99972 1/20 0.55
POLB P06746 2/20 0.55
TRPV1 Q8NER1 1/20 0.54
NPC1 O15118 2/20 0.52
RAB9A P51151 1/20 0.52
DDX3X O00571 1/20 0.49
IDH1 O75874 1/20 0.48

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
SCHEMBL6936821 0.87 MEN1 (0.68) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL6941539 0.85 DDX3X (0.64) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL6941597 0.85 MAPT (0.57) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL6937549 0.84 MEN1 (0.63) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL6939392 0.83 MEN1 (0.79) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL6296073 0.82 MEN1 (0.70) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL6936818 0.80 MEN1 (0.54) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL6939617 0.79 KMT2A (0.60) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL4115432 0.79 MEN1 (0.82) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL4548287 0.79 MEN1 (0.61) MAPTMEN1KMT2AMAPK1HTT

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-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