SCHEMBL4752215

SCHEMBL4752215

CC(=O)c1ccc(C=CC(=O)NCCc2c(C)[nH]c3c(F)ccc(C)c23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 4/20 0.40
ATM Q13315 1/20 0.40
HDAC1 Q13547 2/20 0.39
MAPT P10636 3/20 0.39
NLRP3 Q96P20 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
ALDH1A1 P00352 1/20 0.38
HDAC3 O15379 1/20 0.38
TET3 O43151 1/20 0.38
BRD4 O60885 1/20 0.38
HDAC4 P56524 1/20 0.38
FOXO1 Q12778 1/20 0.38
TET2 Q6N021 1/20 0.38
PIK3C3 Q8NEB9 1/20 0.38
TET1 Q8NFU7 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38

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
SCHEMBL4668502 1.00 MEN1 (0.43) MEN1KMT2ALMNAATMHDAC1
SCHEMBL4668484 0.91 MEN1 (0.44) MEN1KMT2ALMNAHDAC1MAPT
SCHEMBL4017819 0.91 MEN1 (0.47) MEN1KMT2ALMNAHDAC1MAPT
SCHEMBL4669514 0.90 MEN1 (0.46) MEN1KMT2ALMNAHDAC1MAPT
SCHEMBL4754393 0.90 MEN1 (0.46) MEN1KMT2ALMNAHDAC1MAPT
SCHEMBL4017823 0.90 MAPT (0.50) MEN1KMT2ALMNAMAPTNLRP3
SCHEMBL4017820 0.90 MAPT (0.50) MEN1KMT2ALMNAMAPTNLRP3
SCHEMBL4014345 0.90 MMP1 (0.48) MEN1KMT2AMMP1MMP2MMP9
SCHEMBL4016316 0.89 MEN1 (0.43) MEN1KMT2ALMNAHDAC1MAPT
SCHEMBL13982589 0.89 MEN1 (0.43) MEN1KMT2ALMNAHDAC1MAPT

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
WO-2008152097-A1 CINNAMIC ACID DERIVATIVES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO claimed
WO-2008152097-A1 CINNAMIC ACID DERIVATIVES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO disclosed