SCHEMBL8324548

SCHEMBL8324548

COC(=O)c1ccc(/C=C/c2cc(Br)ccc2OCc2ccccc2)cc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
USP2 O75604 1/20 0.54
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
CCR5 P51681 3/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
APP P05067 3/20 0.45

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
SCHEMBL8324551 1.00 LMNA (0.54) LMNAUSP2KDM4EMEN1POLB
SCHEMBL8319694 0.89 PTGER4 (0.53) LMNAKDM4EMEN1POLBKMT2A
SCHEMBL8322341 0.89 PTGER4 (0.53) LMNAKDM4EMEN1POLBKMT2A
SCHEMBL8319700 0.89 PTGER4 (0.53) LMNAKDM4EMEN1POLBKMT2A
SCHEMBL8321448 0.88 APP (0.58) LMNAKDM4EPOLBMAPTHDAC8
SCHEMBL8321452 0.88 APP (0.58) LMNAKDM4EPOLBMAPTHDAC8
SCHEMBL8323623 0.86 GCK (0.56) LMNAKDM4EMEN1MAPTKMT2A
SCHEMBL5431545 0.80 LRRK2 (0.63) LMNAUSP2KDM4EPOLBCCR5
SCHEMBL8327004 0.78 PTGER4 (0.53) KDM4EMAPTHDAC3HDAC4HDAC1
SCHEMBL8322642 0.78 PTGER4 (0.53) KDM4EMAPTHDAC3HDAC4HDAC1

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-0733033-B1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LTD (GB) 1999-12-22 EP disclosed
EP-0733033-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-09-25 EP disclosed