SCHEMBL28067649

SCHEMBL28067649

Oc1ccccc1-c1nc2c(O)cccc2[nH]1.[Zn]

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 9/20 0.74
MGAM O43451 9/20 0.74
SI P14410 8/20 0.74
MGAM2 Q2M2H8 8/20 0.74
PDE5A O76074 1/20 0.62
F7 P08709 1/20 0.56
KDM4E B2RXH2 3/20 0.55
MEN1 O00255 1/20 0.55
NPC1 O15118 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GLA P06280 1/20 0.55
POLB P06746 1/20 0.55
MAPT P10636 1/20 0.55
IDO1 P14902 1/20 0.55
RECQL P46063 1/20 0.55
TDO2 P48775 1/20 0.55
RAB9A P51151 1/20 0.55
KMT2A Q03164 1/20 0.55
ATM Q13315 1/20 0.55
ATR Q13535 1/20 0.49

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
SCHEMBL28067691 0.98 GAA (0.77) GAAMGAMSIMGAM2PDE5A
SCHEMBL8900530 0.90 GAA (0.74) GAAMGAMSIMGAM2PDE5A
SCHEMBL11199113 0.85 MGAM (1.00) GAAMGAMSIMGAM2PDE5A
SCHEMBL8624096 0.81 F7 (0.77) GAAMGAMSIMGAM2PDE5A
SCHEMBL56853 0.81 PARP1 (0.62) GAAMGAMSIMGAM2NPC1
SCHEMBL31049691 0.79 GAA (0.64) GAAMGAMSIMGAM2PDE5A
SCHEMBL27719925 0.79 GAA (0.60) GAAMGAMSIMGAM2PDE5A
SCHEMBL461968 0.79 F7 (0.79) GAAMGAMSIMGAM2PDE5A
SCHEMBL29578227 0.79 F7 (0.79) GAAMGAMSIMGAM2PDE5A
SCHEMBL7430084 0.77 PDE5A (1.00) GAAMGAMSIMGAM2PDE5A

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-105623650-A Proton transfer blue luminescent material and preparation method thereof HENAN PROVINCE MEDICAL INSTR TESTING INST 2016-06-01 CN disclosed