SCHEMBL2006927

SCHEMBL2006927

C=Cc1cnc2cccnc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TGFBR1 P36897 1/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
PARP1 P09874 1/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
MAPT P10636 3/20 0.36
KDM4E B2RXH2 3/20 0.35
PDE10A Q9Y233 2/20 0.34
POLB P06746 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PKM P14618 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.33
OGA O60502 1/20 0.33
CASP3 P42574 1/20 0.33
ATM Q13315 1/20 0.33
SENP7 Q9BQF6 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
SCHEMBL1289832 0.81 KDM4E (0.42) ALDH1A1PDGFRBPDGFRANPC1RAB9A
SCHEMBL29935898 0.81 KDM4E (0.42) ALDH1A1PDGFRBPDGFRANPC1RAB9A
Hydrochloric Acid SCHEMBL28102148 0.79 KDM4E (0.41) ALDH1A1PDGFRBPDGFRANPC1RAB9A
SCHEMBL3274768 0.75 NPC1 (0.45) ALDH1A1TGFBR1NPC1RAB9AMAPT
SCHEMBL13749555 0.75 PDGFRB (0.40) ALDH1A1PDGFRBPDGFRANPC1RAB9A
SCHEMBL31441068 0.74 PDGFRB (0.65) ALDH1A1PDGFRBPDGFRAPARP1RAB9A
SCHEMBL486937 0.74 PDGFRB (0.65) ALDH1A1PDGFRBPDGFRAPARP1RAB9A
SCHEMBL1771992 0.74 ALDH1A1 (0.43) ALDH1A1NPC1RAB9AMAPTKDM4E
SCHEMBL6630673 0.73 ALDH1A1 (0.53) ALDH1A1PDGFRBPDGFRANPC1RAB9A
SCHEMBL27499514 0.73 ALDH1A1 (0.39) ALDH1A1NPC1RAB9AMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1857471-B1 POLYMERIZATION CATALYST COMPOSITION AND PROCESS FOR PRODUCTION OF POLYMER MITSUI CHEMICALS INC (JP) 2013-04-24 EP disclosed
US-7960305-B2 a mixture of a phosphazenium compound such as tetrakis[tris(dimethylamino)phosphoranylideneamino]phosphonium chloride, transition metal halides and an organic halogen compound as an activator, used for addition homo/copolymerization; living polymers MITSUI CHEMICALS, INC. (JP) 2011-06-14 US disclosed
CN-101128491-B Polymerization catalyst composition and method for producing polymer MITSUI CHEMICALS INC 2010-09-08 CN disclosed
US-20080177014-A1 Polymerization Catalyst Composition and Process for Production of Polymer MITSUI CHEMICALS, INC. (JP) 2008-07-24 US disclosed
CN-101128491-A Polymerization catalyst composition and method for producing polymer MITSUI CHEMICALS INC (JP) 2008-02-20 CN disclosed
EP-1857471-A1 POLYMERIZATION CATALYST COMPOSITION AND PROCESS FOR PRODUCTION OF POLYMER Mitsui Chemicals, Inc. (JP) 2007-11-21 EP disclosed