SCHEMBL27907640

SCHEMBL27907640

COc1ccc(-c2cc(-c3cccc4ccccc34)n(C(F)(F)F)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.56
MAPT P10636 5/20 0.46
ACACA Q13085 1/20 0.44
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
BMX P51813 1/20 0.42
ENPP1 P22413 1/20 0.42
HTT P42858 1/20 0.41
GAA P10253 2/20 0.41

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
SCHEMBL28803983 0.84 BMX (0.54) FLT3KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL27890747 0.81 FLT3 (0.44) FLT3MAPTKDM4EALDH1A1HPGD
SCHEMBL27890801 0.81 MAPT (0.55) MAPTACACAKDM4EALDH1A1LMNA
SCHEMBL28803899 0.76 HTR2C (0.40) FLT3BMXCYP11B2
SCHEMBL27907634 0.74 ALDH1A1 (0.46) MAPTKDM4EALDH1A1NPC1RAB9A
SCHEMBL27907531 0.74 HTR2C (0.39) FLT3BMXCYP11B2
SCHEMBL27907529 0.74 FUBP1 (0.45) MAPTKDM4EALDH1A1LMNAHPGD
SCHEMBL27907542 0.74 RIPK2 (0.38) MAPTKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL1890032 0.72 PPARG (0.56) FLT3ACACARAB9AENPP1CYP1A2
SCHEMBL13509027 0.71 FLT3 (0.44) FLT3MAPTKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101906105-B Pyrazolo (1,5-a) pyrimidone derivative as well as drug combination thereof and application thereof UNIV HEBEI MEDICAL 2013-01-16 CN disclosed