SCHEMBL6578751

SCHEMBL6578751

ClNc1nc(-c2ccccc2)nc(N(Cl)Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 3/20 0.39
IDH1 O75874 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ADORA2A P29274 2/20 0.37
ADORA1 P30542 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA2B P29275 1/20 0.37
IDH2 P48735 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
PDE5A O76074 2/20 0.35
ABCG2 Q9UNQ0 1/20 0.35
MAPK1 P28482 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
NOTUM Q6P988 1/20 0.33

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
SCHEMBL6576567 0.83 MEN1 (0.47) MEN1KMT2AHTTLMNAPOLB
SCHEMBL6832298 0.75 ADORA2A (0.64) MEN1KMT2AHTTNPSR1POLB
SCHEMBL1034075 0.69 ALDH1A1 (0.50) MEN1KMT2ALMNAIDH1NPSR1
SCHEMBL28184867 0.67 ALDH1A1 (0.75) MEN1KMT2ANPSR1IDH2ABCG2
SCHEMBL22362211 0.66 L3MBTL1 (0.56) MEN1KMT2AHTTIDH1NPSR1
SCHEMBL12073499 0.66 L3MBTL1 (0.56) MEN1KMT2AHTTLMNAPOLB
SCHEMBL371042 0.65 L3MBTL1 (0.74) MEN1KMT2AHTTLMNAPOLB
SCHEMBL2262628 0.64 LMNA (0.59) MEN1KMT2AHTTLMNAL3MBTL1
SCHEMBL19295118 0.64 MEN1 (0.47) MEN1KMT2AHTTLMNANPSR1
SCHEMBL782301 0.64 MEN1 (0.58) MEN1KMT2AHTTLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930303-B1 A process for preparing isocyanate compounds from haloaminotriazines and acid halides CYTEC TECH CORP (US) 2004-02-04 EP disclosed
EP-0933371-B1 N-halo acid amides CYTEC TECH CORP (US) 2003-04-09 EP disclosed
EP-0565774-B1 Process for preparing amide derivatives from halominotriazines and acid halides CYTEC TECH CORP (US) 2001-03-28 EP disclosed
US-6197957-B1 CATALYTIC REACTION WITH CARBON MONOXIDE CYTEC TECHNOLOGY CORP. 2001-03-06 US disclosed
EP-0933370-A1 Tris-(2,2,6,6-tetramethyl-piperid-4-yl-aminocarbonyl)melamine CYTEC TECHNOLOGY CORP. (US) 1999-08-04 EP disclosed
EP-0933371-A1 N-halo acid amides CYTEC TECHNOLOGY CORP. (US) 1999-08-04 EP disclosed
EP-0933369-A1 Tris-(omega-haloacyl)melamines CYTEC TECHNOLOGY CORP. (US) 1999-08-04 EP disclosed
EP-0930303-A2 A process for preparing isocyanate compounds from haloaminotriazines and acid halides CYTEC TECHNOLOGY CORP. (US) 1999-07-21 EP disclosed
EP-0649842-B1 Process for preparing derivatives of (halo)amino compounds by carbonylation CYTEC TECH CORP (US) 1998-06-03 EP disclosed
US-5571915-A Process for preparing amide derivatives from haloaminotriazines and acid halides CYTEC TECHNOLOGY CORP. (US) 1996-11-05 US disclosed
EP-0649842-A1 Process for preparing derivatives of (halo)amino compounds by carbonylation CYTEC TECHNOLOGY CORP. (US) 1995-04-26 EP disclosed
US-5405959-A Haloaminotraizines and acid halides CYTEC TECHNOLOGY CORP. (US) 1995-04-11 US disclosed
US-5288865-A Process for preparing amide derivatives from haloaminotriazines and acid halides AMERICAN CYANAMID COMPANY (US) 1994-02-22 US disclosed
EP-0565774-A2 Process for preparing amide derivatives from halominotriazines and acid halides CYTEC TECHNOLOGY CORP. (US) 1993-10-20 EP disclosed
EP-0541966-A2 Process for preparing amide derivatives from halomines and acid halides AMERICAN CYANAMID COMPANY (US) 1993-05-19 EP disclosed