SCHEMBL4289963

SCHEMBL4289963

CN(C)c1ccc(N=Nc2ccccc2N2C(=O)C=CC2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.54
RAB9A P51151 8/20 0.54
KMT2A Q03164 8/20 0.54
MEN1 O00255 6/20 0.54
ALPL P05186 2/20 0.54
ALPG P10696 2/20 0.54
ALPI P09923 1/20 0.54
MYC P01106 1/20 0.52
MAPK1 P28482 7/20 0.51
TDP1 Q9NUW8 4/20 0.51
ALDH1A1 P00352 2/20 0.51
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TLR9 Q9NR96 1/20 0.44
MAPT P10636 7/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
CASP3 P42574 2/20 0.44
SENP8 Q96LD8 2/20 0.44
SENP7 Q9BQF6 2/20 0.44

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
SCHEMBL29032696 0.83 TLR9 (0.55) KMT2AMEN1MAPK1TDP1ALDH1A1
SCHEMBL458382 0.79 MGLL (0.52) NPC1RAB9AKMT2AMEN1MAPK1
SCHEMBL4289960 0.79 MGLL (0.52) NPC1RAB9AKMT2AMEN1MAPK1
SCHEMBL27650867 0.75 MGLL (0.50) NPC1RAB9AKMT2AMEN1MAPK1
SCHEMBL5982208 0.72 NPC1 (0.67) NPC1RAB9AKMT2AMEN1ALPL
SCHEMBL11036682 0.72 KMT2A (0.67) NPC1RAB9AKMT2AMEN1ALPL
SCHEMBL5982202 0.72 NPC1 (0.67) NPC1RAB9AKMT2AMEN1ALPL
SCHEMBL157008 0.71 NPC1 (0.61) NPC1RAB9AKMT2AMEN1ALPL
SCHEMBL157009 0.71 NPC1 (0.61) NPC1RAB9AKMT2AMEN1ALPL
SCHEMBL28331876 0.71 KMT2A (0.56) NPC1RAB9AKMT2AMEN1ALPL

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273705-B2 Conversion of apoptotic proteins THE BURNHAM INSTITUTE (US) 2012-09-25 US disclosed
US-20090215984-A1 CONVERSION OF APOPTOTIC PROTEINS THE BURNHAM INSTITUTE (US) 2009-08-27 US disclosed
US-7491700-B2 Conversion of apoptotic proteins THE BURNHAM INSTITUTE (US) 2009-02-17 US disclosed
US-20070117753-A1 CONVERSION OF APOPTOTIC PROTEINS THE BURNHAM INSTITUTE (US) 2007-05-24 US disclosed
US-7176277-B2 Conversion of apoptotic proteins THE BURNHAM INSTITUTE (US) 2007-02-13 US disclosed
US-20060193864-A1 Conversion of apoptotic proteins NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2006-08-31 US disclosed
US-6994979-B2 Conversion of apoptotic proteins THE BURNHAM INSTITUTE (US) 2006-02-07 US disclosed
US-20040220097-A1 Conversion of apoptotic proteins NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-11-04 US disclosed
WO-2004052920-A9 CONVERSION OF APOPTOTIC PROTEINS BURNHAM INST (US) 2004-08-19 WO disclosed
WO-2004052920-A2 CONVERSION OF APOPTOTIC PROTEINS THE BURNHAM INSTITUTE (US) 2004-06-24 WO disclosed