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Sugi Predict / Compounds / SCHEMBL26948461

SCHEMBL26948461

SCHEMBL26948461

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3)c3cc4c(cc3-c3ccc5c(c3)CCCC5)-c3ccccc3C4(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL26947504 0.98 KDM4E (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26948531 0.98 KDM4E (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26948527 0.98 KDM4E (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26947503 0.97 KDM4E (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26947570 0.97 KDM4E (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26948602 0.96 KDM4E (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26947986 0.96 CYP11B1 (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26947984 0.96 CYP11B1 (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL26948561 0.94 CYP11B1 (0.33) CYP11B1CYP11B2FFAR4
SCHEMBL26947983 0.94 KDM4E (0.34) KDM4EMEN1LMNAMAPTOPRK1

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
WO-2023239091-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-12-14 — — WO disclosed
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