SCHEMBL1376228

SCHEMBL1376228

Nc1ncc(Oc2ccc(Cl)cc2)c(N[C@@H]2CCC[C@@H]2O)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CNR2 P34972 2/20 0.39
CNR1 P21554 3/20 0.38
CSF1R P07333 6/20 0.36
PDGFRB P09619 6/20 0.36
PDGFRA P16234 6/20 0.36
KIT P10721 5/20 0.36
FLT3 P36888 5/20 0.36
KCNH2 Q12809 2/20 0.36
SCN9A Q15858 2/20 0.36
MAPK8 P45983 1/20 0.36
SCN5A Q14524 1/20 0.36
IDH1 O75874 1/20 0.36
LATS1 O95835 2/20 0.36

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
SCHEMBL1376071 1.00 KDM4E (0.39) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL1376073 1.00 KDM4E (0.39) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL5202820 0.98 KDM4E (0.41) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL5202818 0.98 KDM4E (0.41) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL5206452 0.98 KDM4E (0.41) KDM4EMEN1NPC1MAPTKMT2A
Hydrochloric Acid SCHEMBL5204801 0.97 KDM4E (0.40) KDM4EMEN1NPC1MAPTKMT2A
Hydrochloric Acid SCHEMBL5204803 0.97 KDM4E (0.40) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL1376481 0.91 MAPK8 (0.38) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL1376484 0.91 MAPK8 (0.38) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL1375470 0.86 CNR1 (0.35) KDM4EMEN1NPC1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4743463-B2 2011-08-10 JP claimed
EP-1165523-B1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC (US) 2007-11-07 EP claimed
US-6583148-B1 Neurodegenerative or other neurological disorders; enhancing the effect of nerve growth factor; 2-Amino-5-(4-chlorophenoxy)-4-trans-4-hydroxycyclohexylamino) pyrimidine KRENITSKY PHARMACEUTICALS, INC. 2003-06-24 US claimed
JP-2002541245-A 2002-12-03 JP claimed
EP-1165523-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES Krenitsky Pharmaceuticals, Inc. (US) 2002-01-02 EP claimed
WO-2000061562-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC. (US) 2000-10-19 WO claimed
EP-1165523-B1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC (US) 2007-11-07 EP disclosed
US-6916820-B1 Neurotrophic substituted pyrimidines KRENITSKY PHARMACEUTICALS, INC. (US) 2005-07-12 US disclosed
US-6583148-B1 Neurodegenerative or other neurological disorders; enhancing the effect of nerve growth factor; 2-Amino-5-(4-chlorophenoxy)-4-trans-4-hydroxycyclohexylamino) pyrimidine KRENITSKY PHARMACEUTICALS, INC. 2003-06-24 US disclosed
EP-1165523-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES Krenitsky Pharmaceuticals, Inc. (US) 2002-01-02 EP disclosed
WO-2000061562-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC. (US) 2000-10-19 WO disclosed