SCHEMBL29346885

SCHEMBL29346885

COC(=O)c1cccc(OCC(=O)OC(C)(C)C)c1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 1/20 0.42
▸ DDB1 Q16531 1/20 0.42
▸ CRBN Q96SW2 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ SLC6A3 Q01959 2/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ CYP1A2 P05177 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CYP2C19 P33261 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL29346886 0.86 KDM4E (0.43) MRGPRX4DDB1CRBNALDH1A1TSHR
SCHEMBL31748123 0.86 KDM4E (0.43) MRGPRX4DDB1CRBNALDH1A1TSHR
SCHEMBL20235270 0.86 ALDH1A1 (0.52) ALDH1A1TSHRSLC6A3CYP1A2MEN1
SCHEMBL31425872 0.86 ALDH1A1 (0.52) ALDH1A1TSHRSLC6A3CYP1A2MEN1
SCHEMBL30211189 0.85 DDB1 (0.42) DDB1CRBNALDH1A1TSHRSLC6A3
SCHEMBL20919582 0.85 DDB1 (0.42) DDB1CRBNALDH1A1TSHRSLC6A3
SCHEMBL20510109 0.82 FFAR4 (0.52) DDB1CRBNALDH1A1TSHRSLC6A3
SCHEMBL31474122 0.80 ALDH1A1 (0.43) MRGPRX4ALDH1A1TSHRSLC6A3SLC6A4
SCHEMBL22656552 0.76 POLB (0.50) DDB1CRBNALDH1A1TSHRMEN1
SCHEMBL21643441 0.76 MTNR1A (0.45) MRGPRX4MEN1KMT2AMAPTLMNA

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-2024150815-A1 CEREBLON E3 LIGASE BINDING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PRODUCTION METHOD THEREFOR 田辺三菱製薬株式会社 2024-07-18 — — WO disclosed
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