SCHEMBL28349754

SCHEMBL28349754

Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[Co]

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 5/20 0.60
▸ TOP1 P11387 4/20 0.58
▸ CYCS P99999 3/20 0.57
▸ ENPP2 Q13822 1/20 0.55
▸ ABCG2 Q9UNQ0 1/20 0.55

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
SCHEMBL242168 0.98 TERT (0.62) TERTTOP1CYCSENPP2ABCG2
SCHEMBL29693624 0.98 TERT (0.62) TERTTOP1CYCSENPP2ABCG2
SCHEMBL25407804 0.96 TERT (0.65) TERTTOP1CYCSENPP2ABCG2
SCHEMBL31268231 0.96 TERT (0.60) TERTTOP1CYCSENPP2ABCG2
SCHEMBL28507509 0.96 TERT (0.60) TERTTOP1CYCSENPP2ABCG2
SCHEMBL31040346 0.96 TERT (0.60) TERTTOP1CYCSENPP2ABCG2
SCHEMBL31182124 0.96 TERT (0.60) TERTTOP1CYCSENPP2ABCG2
SCHEMBL31040342 0.96 TERT (0.60) TERTTOP1CYCSENPP2ABCG2
SCHEMBL31375135 0.96 TERT (0.60) TERTTOP1CYCSENPP2ABCG2
SCHEMBL28482323 0.96 TERT (0.60) TERTTOP1CYCSENPP2ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110483222-B Selective oxidation method of ethylbenzene compound 浙江工业大学 2022-06-21 — — CN disclosed
CN-110563590-B Method for selective oxidation of toluene compounds 浙江工业大学 2022-03-18 — — CN disclosed
CN-110563590-A Method for selective oxidation of toluene compounds 浙江工业大学 2019-12-13 — — CN disclosed
CN-110563555-A Method for oxidizing cycloparaffin through synergetic catalysis of cobalt (II)/zinc (II) porphyrin salt 浙江工业大学 2019-12-13 — — CN disclosed
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