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Sugi Predict / Compounds / SCHEMBL24752453

SCHEMBL24752453

SCHEMBL24752453

c1ccc(-c2ccc(-c3cc(-c4ccc(-c5cccc(-c6ccc7c8ccccc8n(-c8cccc(-c9cccc(-c%10nc(-c%11cccc(-c%12ccccc%12)c%11)cc(-c%11ccc(-c%12cccc(-c%13ccc%14c%15ccccc%15n(-c%15ccccc%15)c%14c%13)c%12)c%12ccccc%11%12)n%10)c9)c8)c7c6)c5)c5ccccc45)nc(-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ HPGD P15428 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ NTSR1 P30989 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.33
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ AVPR1A P37288 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 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
SCHEMBL24753859 0.96 KDM4E (0.41) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL26432074 0.96 KDM4E (0.41) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL26432072 0.96 KDM4E (0.41) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL24752450 0.95 KDM4E (0.42) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL24752072 0.94 KDM4E (0.41) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL24752197 0.94 MEN1 (0.39) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL26432130 0.93 KDM4E (0.40) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL17714777 0.92 KDM4E (0.44) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL26431945 0.92 KDM4E (0.41) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL24753860 0.92 KDM4E (0.44) MEN1KMT2AHPGDKDM4EALDH1A1

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
EP-4101851-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd (JP) 2022-12-14 — — EP disclosed
EP-4101847-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd (JP) 2022-12-14 — — EP disclosed
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