SCHEMBL28462569

SCHEMBL28462569

Oc1ccc(-c2cc3cc4nc(cc5ccc([nH]5)c(-c5ccccc5)c5nc(c(-c6ccccc6)c2[nH]3)C=C5)C=C4)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.59
▸ STAT1 P42224 1/20 0.59
▸ TOP1 P11387 4/20 0.39
▸ CYCS P99999 3/20 0.39
▸ ENPP2 Q13822 1/20 0.36
▸ TERT O14746 2/20 0.34
▸ ESR1 P03372 2/20 0.33
▸ ESR2 Q92731 2/20 0.33
▸ CHEK1 O14757 1/20 0.33
▸ WEE1 P30291 1/20 0.33
▸ CCNB2 O95067 1/20 0.33
▸ CCNE2 O96020 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CDK4 P11802 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ CCND1 P24385 1/20 0.33
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ CCNB3 Q8WWL7 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.32

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
SCHEMBL28406752 0.97 STAT3 (0.63) STAT3STAT1TOP1CYCSENPP2
SCHEMBL28311233 0.94 STAT3 (0.55) STAT3STAT1TOP1CYCSENPP2
SCHEMBL31276120 0.94 STAT3 (0.55) STAT3STAT1TOP1CYCSENPP2
SCHEMBL28008850 0.94 STAT3 (0.67) STAT3STAT1TOP1CYCSENPP2
SCHEMBL28188073 0.90 STAT3 (0.72) STAT3STAT1TOP1CYCSENPP2
SCHEMBL28402436 0.90 STAT3 (0.59) STAT3STAT1TOP1CYCSENPP2
SCHEMBL28024655 0.87 STAT3 (0.62) STAT3STAT1TOP1CYCSENPP2
SCHEMBL29904993 0.87 STAT3 (0.62) STAT3STAT1TOP1CYCSENPP2
SCHEMBL29253192 0.86 STAT3 (0.63) STAT3STAT1TOP1CYCSENPP2
SCHEMBL27940870 0.86 STAT3 (0.63) STAT3STAT1TOP1CYCSENPP2

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-111777767-B Fluorescent nano probe for detecting hydrogen sulfide by liver-targeting zero-crosstalk ratio and preparation and application thereof 湖南科技大学 2022-05-13 — — CN disclosed
CN-111777767-A Fluorescent nano probe for detecting hydrogen sulfide by liver-targeting zero-crosstalk ratio and preparation and application thereof 湖南科技大学 2020-10-16 — — CN disclosed
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