SCHEMBL16355188

SCHEMBL16355188

CCCOc1ccc(C2=NC(c3ccccc3Cl)(n3c(-c4ccccc4Cl)nc(-c4ccccc4)c3-c3ccc(OCCC)cc3)N=C2c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 7/20 0.41
MAPT P10636 2/20 0.37
APP P05067 2/20 0.37
GAA P10253 1/20 0.36
AKT1 P31749 1/20 0.35
AKT2 P31751 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
TP53 P04637 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FAAH O00519 1/20 0.34
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
ATP4A P20648 1/20 0.33
ATP4B P51164 1/20 0.33
FABP4 P15090 1/20 0.33
FABP5 Q01469 1/20 0.33

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
SCHEMBL16355190 0.97 BACE1 (0.39) BACE1MAPTAPPGAAAKT1
SCHEMBL16746566 0.90 BACE1 (0.35) BACE1MAPTAPPDRD2DRD3
SCHEMBL16355186 0.88 KDM4E (0.43) BACE1MAPTAPPGAAKDM4E
SCHEMBL16355187 0.88 KDM4E (0.43) BACE1MAPTAPPGAAKDM4E
SCHEMBL23816974 0.88 BACE1 (0.33) BACE1MAPTAPPAKT1AKT2
SCHEMBL23816986 0.88 BACE1 (0.33) BACE1MAPTAPPAKT1AKT2
SCHEMBL29359500 0.87 HSD11B1 (0.37) GAAAKT1AKT2KDM4EALDH1A1
SCHEMBL307038 0.87 HSD11B1 (0.37) GAAAKT1AKT2KDM4EALDH1A1
SCHEMBL29749791 0.87 HSD11B1 (0.37) GAAAKT1AKT2KDM4EALDH1A1
SCHEMBL3101056 0.86 KDM4E (0.39) BACE1MAPTAPPGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140374677-A1 COLORED COMPOSITION, COLORED PHOTOSENSITIVE COMPOSITION, COLOR FILTER AND LIQUID CRYSTAL DISPLAY DEVICE EQUIPPED WITH SAME, ORGANIC EL DISPLAY DEVICE, AND SOLID-STATE IMAGE SENSOR FUJIFILM CORPORATION (JP) 2014-12-25 US disclosed
US-20140374677-A1 COLORED COMPOSITION, COLORED PHOTOSENSITIVE COMPOSITION, COLOR FILTER AND LIQUID CRYSTAL DISPLAY DEVICE EQUIPPED WITH SAME, ORGANIC EL DISPLAY DEVICE, AND SOLID-STATE IMAGE SENSOR FUJIFILM CORPORATION (JP) 2014-12-25 US disclosed