SCHEMBL29196605

SCHEMBL29196605

CCCCCc1cccc(CCCCC)c1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.47
MCL1 Q07820 3/20 0.47
BCL2L1 Q07817 2/20 0.47
BAK1 Q16611 2/20 0.47
KAT8 Q9H7Z6 2/20 0.47
SAE1 Q9UBE0 2/20 0.47
PPARA Q07869 2/20 0.47
PPARG P37231 1/20 0.47
EP300 Q09472 1/20 0.47
KAT2A Q92830 1/20 0.47
KAT2B Q92831 1/20 0.47
KAT5 Q92993 1/20 0.47
LIPG Q9Y5X9 1/20 0.47
ALOX5 P09917 1/20 0.46
PTGS2 P35354 1/20 0.46
GPR84 Q9NQS5 1/20 0.44
F7 P08709 3/20 0.44
F3 P13726 3/20 0.44
MMP2 P08253 2/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL955871 0.94 GAA (0.42) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL952521 0.90 GAA (0.41) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9513460 0.90 ALOX5 (0.43) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL1527143 0.88 BID (0.56) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL7745169 0.88 BID (0.45) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL30600442 0.88 LIPG (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL442122 0.86 BID (0.59) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9497537 0.86 BID (0.59) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9493738 0.86 BID (0.59) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL150234 0.86 BID (0.59) BIDMCL1BCL2L1BAK1KAT8

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-117886685-A 1, 3-diaryl formyl benzene compound and preparation method and application thereof 浙江工业大学 2024-04-16 CN claimed
CN-117886685-A 1, 3-diaryl formyl benzene compound and preparation method and application thereof 浙江工业大学 2024-04-16 CN disclosed
CN-117886685-A 1, 3-diaryl formyl benzene compound and preparation method and application thereof 浙江工业大学 2024-04-16 CN disclosed
CN-117886685-A 1, 3-diaryl formyl benzene compound and preparation method and application thereof 浙江工业大学 2024-04-16 CN disclosed