SCHEMBL7242574

SCHEMBL7242574

O=C1C=NCc2ccccc2N1Cc1cccc(F)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.59
MEN1 O00255 3/20 0.59
UBE2N P61088 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP2C9 P11712 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP1A2 P05177 1/20 0.44
GAA P10253 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 3/20 0.44
ALDH3A1 P30838 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NR3C2 P08235 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
TP53 P04637 1/20 0.41
DRD2 P14416 1/20 0.40

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
SCHEMBL7244783 0.85 POLB (0.55) KMT2AMEN1CYP2C9SMN1; SMN2CYP1A2
SCHEMBL7251023 0.79 LMNA (0.46) KMT2AMEN1UBE2NTDP1GAA
SCHEMBL4994825 0.78 KMT2A (0.56) KMT2AMEN1UBE2NTDP1CYP2C9
SCHEMBL7244603 0.77 SIRT2 (0.44) KMT2AMEN1CYP2C9SMN1; SMN2CYP1A2
SCHEMBL6306501 0.76 KMT2A (0.67) KMT2AMEN1UBE2NTDP1CYP2C9
SCHEMBL7839981 0.75 FAAH (0.49) KMT2AMEN1GAAALDH1A1MAPT
SCHEMBL7248765 0.75 HTT (0.50) KMT2AMEN1TDP1GAANPSR1
SCHEMBL7242765 0.75 GSK3A (0.49) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL7247950 0.74 ADRA2A (0.44) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL7248746 0.73 GSK3A (0.51) TDP1SMN1; SMN2ALDH1A1ALDH3A1MAPT

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
US-6632811-B2 Administering cycloalkyl, lactam, lactone compounds for for inhibiting beta -amyloid peptide release and/or its synthesis in a cell ATHENA NEUROSCIENCES, INC. 2003-10-14 US disclosed