SCHEMBL28831711

SCHEMBL28831711

CCC=Cc1cccc(C(C)O)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ UGT2B7 P16662 1/20 0.38
▸ BRD4 O60885 1/20 0.38
▸ BRD2 P25440 1/20 0.38
▸ CREBBP Q92793 1/20 0.38
▸ HTR2A P28223 3/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ EPOR P19235 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ CYP3A4 P08684 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL16167426 0.86 HDAC4 (0.42) KDM4EHTR2AHDAC4HDAC2HDAC8
SCHEMBL16167432 0.86 HDAC4 (0.42) KDM4EHTR2AHDAC4HDAC2HDAC8
SCHEMBL16167078 0.83 HDAC4 (0.50) HTR2AHDAC4HDAC2HDAC8EPOR
SCHEMBL16167074 0.83 HDAC4 (0.50) HTR2AHDAC4HDAC2HDAC8EPOR
SCHEMBL8498450 0.82 KDM4E (0.43) KDM4E
SCHEMBL31149192 0.79 NFE2L2 (0.41) HTR2A
SCHEMBL9442305 0.76 LMNA (0.49) ALDH1A1HTTTSHRCYP3A4LMNA
SCHEMBL6035255 0.76 TP53 (0.52) KDM4EMEN1KMT2AUGT2B7BRD4
SCHEMBL14635005 0.76 TP53 (0.52) KDM4EMEN1KMT2AUGT2B7BRD4
SCHEMBL13703006 0.75 HTR2A (0.42) KDM4EHTR2AHDAC4HDAC2HDAC8

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-114847358-A Non-dairy cheese replica comprising a coacervate 非凡食品有限公司 2022-08-05 — — CN disclosed
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