SCHEMBL31259501

SCHEMBL31259501

Cc1cc(C)cc(-c2oc3cc(C)c(O)c(C)c3c(=O)c2C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLH Q9Y253 2/20 0.46
▸ ALOX5 P09917 3/20 0.43
▸ PIM1 P11309 3/20 0.41
▸ KDR P35968 3/20 0.41
▸ NUAK1 O60285 2/20 0.41
▸ IGF1R P08069 2/20 0.41
▸ SRC P12931 2/20 0.41
▸ PLK1 P53350 2/20 0.41
▸ PKN1 Q16512 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ ALK Q9UM73 2/20 0.41
▸ MET P08581 1/20 0.41
▸ AXL P30530 1/20 0.41
▸ NEK2 P51955 1/20 0.41
▸ PTK2 Q05397 1/20 0.41
▸ NEK6 Q9HC98 1/20 0.41
▸ MAPK8 P45983 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ CYP3A4 P08684 3/20 0.39
▸ CYP2C9 P11712 3/20 0.39

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
SCHEMBL31259502 0.82 POLH (0.46) POLHALOX5PIM1KDRNUAK1
SCHEMBL22244160 0.71 POLH (0.50) POLHALOX5PIM1KDRNUAK1
SCHEMBL13552041 0.71 MEN1 (0.76) POLHALOX5PIM1KDRNUAK1
SCHEMBL12557415 0.70 POLH (0.62) POLHALOX5PIM1KDRNUAK1
SCHEMBL9565912 0.70 POLH (0.65) POLHALOX5PIM1KDRNUAK1
SCHEMBL16682483 0.69 POLH (0.77) POLHALOX5PIM1KDRNUAK1
SCHEMBL12557413 0.69 POLH (0.50) POLHALOX5PIM1KDRNUAK1
SCHEMBL25734128 0.68 POLH (0.49) POLHALOX5ALDH1A1CYP3A4CYP2C9
SCHEMBL10665463 0.67 CYP3A4 (0.55) POLHALOX5PIM1ALDH1A1CYP3A4
SCHEMBL29158205 0.67 CYP3A4 (0.62) POLHALOX5KDRALDH1A1CYP3A4

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-118834192-A 4' -Hydroxy-3, 5, 7, 3', 5' -pentamethoxyl flavone, enzymatic biosynthesis, separation preparation method and lipid-lowering activity improvement research 江南大学 2024-10-25 — — CN disclosed
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