SCHEMBL2925367

SCHEMBL2925367

Nc1cccc(F)c1Oc1ccnc(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 6/20 0.43
POLB P06746 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TRPA1 O75762 1/20 0.34
HTR1A P08908 3/20 0.33
SLC6A2 P23975 3/20 0.33
KDM4E B2RXH2 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
LOX P28300 1/20 0.33
LOXL3 P58215 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
FEN1 P39748 2/20 0.33
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL190888 0.89 GCK (0.51) GCKPOLBHSP90AA1MAPTTRPA1
SCHEMBL2409849 0.80 GCK (0.37) GCKPOLBHSP90AA1MAPTKDM4E
SCHEMBL14661741 0.79 GCK (0.43) GCKGRM5
SCHEMBL29834775 0.77 NR4A1 (0.41) LOXLOXL3LOXL2ALDH1A1GRM5
SCHEMBL573471 0.77 NR4A1 (0.41) LOXLOXL3LOXL2ALDH1A1GRM5
SCHEMBL27849454 0.77 NR4A1 (0.41) MEN1KMT2ALOXLOXL3LOXL2
SCHEMBL190964 0.76 GCK (0.51) GCKPOLBHSP90AA1MAPTMEN1
SCHEMBL192869 0.76 SMN1; SMN2 (0.40) GCKKMT2ATRPA1SMN1; SMN2LOX
SCHEMBL106458 0.75 MET (0.37) GCKMAPTMEN1KMT2AKDM4E
SCHEMBL139052 0.73 MPO (0.40) GCKLOXLOXL3LOXL2FEN1

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-2148677-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2010-02-03 EP disclosed
WO-2008131276-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-10-30 WO disclosed