SCHEMBL29152800

SCHEMBL29152800

Oc1c(-c2ccccc2)c(CP(c2ccccc2)c2ccccc2)c(-c2ccccc2)c(CP(c2ccccc2)c2ccccc2)c1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 3/20 0.35
▸ PDE4B Q07343 3/20 0.35
▸ PDE4C Q08493 3/20 0.35
▸ PDE4D Q08499 3/20 0.35
▸ ESR1 P03372 4/20 0.35
▸ ESR2 Q92731 4/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ RCE1 Q9Y256 1/20 0.35
▸ HDAC4 P56524 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPT P10636 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ MMP3 P08254 1/20 0.31

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
SCHEMBL29083603 0.85 GCGR (0.41) ESR1ESR2LMNASMN1; SMN2MAPT
SCHEMBL30671665 0.72 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DESR1
SCHEMBL30671670 0.72 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DESR1
SCHEMBL29126122 0.72 ESR1 (0.35) ESR1ESR2KDM4EGAASMN1; SMN2
SCHEMBL29152807 0.70 ESR1 (0.35) ESR1ESR2SMN1; SMN2
SCHEMBL1754108 0.70 PDE4B (0.52) PDE4APDE4BPDE4CPDE4DHDAC4
SCHEMBL29001722 0.70 PDE4B (0.58) PDE4APDE4BPDE4CPDE4DHDAC4
SCHEMBL29059137 0.68 HSPA5 (0.50) KDM4E
SCHEMBL29059042 0.68 BACE1 (0.53) ESR1ESR2KDM4EHDAC4HDAC2
SCHEMBL29126117 0.68 CDK1 (0.35) ESR1ESR2LMNA

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
CN-117209364-A Substituted phenol compound and preparation method and application thereof 中国石油化工股份有限公司 2023-12-12 — — CN disclosed
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