SCHEMBL3129548

SCHEMBL3129548

COc1ccc(C(N)c2cncs2)cc1OC(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
PDE4A P27815 6/20 0.37
PDE4B Q07343 3/20 0.37
PDE4C Q08493 3/20 0.37
PDE4D Q08499 3/20 0.37
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
ACHE P22303 2/20 0.34
ATM Q13315 1/20 0.33
GRM4 Q14833 1/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32

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
SCHEMBL3207724 0.89 PDE4A (0.36) PDE4A
SCHEMBL3120994 0.89 L3MBTL1 (0.39) L3MBTL1PDE4BACHEATMCYP2C9
SCHEMBL3128372 0.82 L3MBTL1 (0.41) L3MBTL1PDE4APDE4BPDE4CPDE4D
SCHEMBL3126008 0.80 MAPT (0.43) L3MBTL1LMNAHPGDTSHRMAPK1
SCHEMBL3118073 0.78 PDE4B (0.44) L3MBTL1PDE4APDE4BPDE4CPDE4D
SCHEMBL3120367 0.76 L3MBTL1 (0.39) L3MBTL1PDE4APDE4BPDE4CPDE4D
SCHEMBL3129210 0.76 PDE4D (0.43) L3MBTL1PDE4APDE4BPDE4CPDE4D
SCHEMBL3131168 0.75 SLC6A2 (0.40) LMNAHPGDMAPK1SMN1; SMN2KMT2A
SCHEMBL3131812 0.75 ATM (0.54) L3MBTL1PDE4APDE4BPDE4CPDE4D
SCHEMBL3129484 0.73 F7 (0.43)

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
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed