SCHEMBL28502855

SCHEMBL28502855

Clc1cccc(-c2c3nc(c(-c4cccc(Cl)c4)c4ccc([nH]4)c(-c4cccc(Cl)c4)c4nc(c(-c5cccc(Cl)c5)c5ccc2[nH]5)C=C4)C=C3)c1.[Cu]

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 3/20 0.48
▸ ENPP2 Q13822 1/20 0.47
▸ STAT3 P40763 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ TOP1 P11387 2/20 0.45
▸ CYCS P99999 3/20 0.44
▸ GRIN2D O15399 1/20 0.44
▸ GRIN3B O60391 1/20 0.44
▸ GRIN1 Q05586 1/20 0.44
▸ GRIN2A Q12879 1/20 0.44
▸ GRIN2B Q13224 1/20 0.44
▸ GRIN2C Q14957 1/20 0.44
▸ GRIN3A Q8TCU5 1/20 0.44
▸ MGAM O43451 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ SI P14410 1/20 0.42
▸ MGAM2 Q2M2H8 1/20 0.42
▸ MET P08581 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41

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
SCHEMBL31456102 0.98 TERT (0.49) TERTENPP2STAT3STAT1TOP1
SCHEMBL10612080 0.98 TERT (0.49) TERTENPP2STAT3STAT1TOP1
SCHEMBL28280078 0.97 TERT (0.48) TERTENPP2STAT3STAT1TOP1
SCHEMBL29437855 0.97 TERT (0.48) TERTENPP2STAT3STAT1TOP1
SCHEMBL28365943 0.97 TERT (0.48) TERTENPP2STAT3STAT1TOP1
SCHEMBL28496366 0.97 TERT (0.48) TERTENPP2STAT3STAT1TOP1
SCHEMBL28508909 0.97 TERT (0.48) TERTENPP2STAT3STAT1TOP1
SCHEMBL28365760 0.97 TERT (0.48) TERTENPP2STAT3STAT1TOP1
SCHEMBL28327090 0.89 ENPP2 (0.50) TERTENPP2STAT3STAT1TOP1
SCHEMBL28281672 0.86 TERT (0.51) TERTENPP2STAT3STAT1TOP1

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
CN-111995556-A Method for synthesizing cumene hydroperoxide by catalytic oxidation of cumene with copper (II) porphyrin 浙江工业大学 2020-11-27 — — CN claimed
CN-111995556-A Method for synthesizing cumene hydroperoxide by catalytic oxidation of cumene with copper (II) porphyrin 浙江工业大学 2020-11-27 — — CN disclosed
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