SCHEMBL9405302

SCHEMBL9405302

CCNc1ccc(C(O)(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.47
SLC2A1 P11166 1/20 0.46
SLC6A3 Q01959 2/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CHEK1 O14757 1/20 0.35
PIM1 P11309 1/20 0.35
LTK P29376 1/20 0.35
LIMK1 P53667 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
ALDH1A1 P00352 4/20 0.33
MAPT P10636 4/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.33
RAB9A P51151 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 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
SCHEMBL29357242 0.88 IDO1 (0.46) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL2389945 0.88 IDO1 (0.46) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL2390176 0.82 SLC2A1 (0.46) SLC2A1SLC6A3KEAP1NFE2L2CYP3A4
SCHEMBL31150865 0.82 SLC2A1 (0.46) SLC2A1SLC6A3KEAP1NFE2L2CYP3A4
SCHEMBL29743074 0.73 SLC2A1 (0.49) SLC2A1SLC6A3CYP3A4CYP2D6ALDH1A1
SCHEMBL27540827 0.73 IDO1 (0.42) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL7875807 0.71 IDO1 (0.40) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL27656699 0.70 IDO1 (0.56) IDO1KEAP1NFE2L2CHEK1PIM1
SCHEMBL5009559 0.70 IDO1 (0.45) IDO1SLC2A1SLC6A3KEAP1NFE2L2
Hydrochloric Acid SCHEMBL14895281 0.69 IDO1 (0.44) IDO1SLC2A1SLC6A3KEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6287498-A None JP disclosed
CN-113980194-A Organic silicon modified hydroxyl epoxy acrylic resin, UV ink and preparation method thereof 厦门格林泰新材料科技有限公司 2022-01-28 CN disclosed
JP-H06287498-A OIL BASED BLUE INK PENTEL KK 1994-10-11 JP disclosed