SCHEMBL5259486

SCHEMBL5259486

COCOc1cccc2cccnc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.60
LMNA P02545 5/20 0.60
NPC1 O15118 4/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
MAPT P10636 7/20 0.57
KDM4E B2RXH2 6/20 0.56
GAA P10253 2/20 0.56
POLB P06746 2/20 0.54
ALDH1A1 P00352 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MAPK1 P28482 2/20 0.51
PDE10A Q9Y233 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51

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
SCHEMBL10707617 0.85 MAPT (0.57) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL1101341 0.84 MAPT (0.69) RAB9ALMNANPC1MEN1KMT2A
Hydrochloric Acid SCHEMBL9052047 0.83 MAPT (0.67) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL2485359 0.83 RAB9A (0.75) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL1101347 0.81 MAPT (0.68) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL8135776 0.81 LMNA (0.47) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL30614510 0.81 MEN1 (0.68) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL170428 0.81 MEN1 (0.68) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL21241466 0.80 PSMD14 (0.53) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL9057120 0.80 LMNA (0.55) RAB9ALMNANPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1824869-A1 MACROLONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-08-29 EP disclosed
WO-2006050941-A1 MACROLONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2006-05-18 WO disclosed
EP-0670315-A1 Triazole oxime derivatives having antimycotic acitivity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-09-06 EP disclosed
EP-0284203-A2 Erythromycin derivatives, process for their preparation and their pharmaceutical use BEECHAM GROUP PLC (GB) 1988-09-28 EP disclosed