SCHEMBL4668484

SCHEMBL4668484

Cc1[nH]c2c(F)ccc(C)c2c1CCNC(=O)/C=C/c1ccc(C(N)=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 3/20 0.38
NLRP3 Q96P20 1/20 0.38
ESR1 P03372 3/20 0.38
HDAC3 O15379 3/20 0.37
HDAC1 Q13547 3/20 0.37
NCOR2 Q9Y618 2/20 0.37
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
ALDH1A1 P00352 1/20 0.37
HDAC4 P56524 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
TET3 O43151 1/20 0.37
BRD4 O60885 1/20 0.37
FOXO1 Q12778 1/20 0.37
TET2 Q6N021 1/20 0.37
PIK3C3 Q8NEB9 1/20 0.37
TET1 Q8NFU7 1/20 0.37

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 0.91 MEN1 (0.43) MEN1KMT2AMAPTNLRP3ESR1
SCHEMBL4752215 0.91 MEN1 (0.43) MEN1KMT2AMAPTNLRP3ESR1
SCHEMBL13982589 0.90 MEN1 (0.43) MEN1KMT2AMAPTNLRP3HDAC3
SCHEMBL4017819 0.90 MEN1 (0.47) MEN1KMT2AMAPTNLRP3HDAC3
SCHEMBL4669514 0.90 MEN1 (0.46) MEN1KMT2AMAPTNLRP3HDAC3
SCHEMBL4754393 0.90 MEN1 (0.46) MEN1KMT2AMAPTNLRP3HDAC3
SCHEMBL4014345 0.89 MMP1 (0.48) MEN1KMT2AESR1ESR2MMP1
SCHEMBL4017820 0.89 MAPT (0.50) MEN1KMT2AMAPTNLRP3LMNA
SCHEMBL4017823 0.89 MAPT (0.50) MEN1KMT2AMAPTNLRP3LMNA
SCHEMBL4669256 0.89 MEN1 (0.41) MEN1KMT2AMAPTHDAC3HDAC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2003118-A1 Cinnamic acid derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP claimed
WO-2008152097-A1 CINNAMIC ACID DERIVATIVES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO disclosed
EP-2003118-A1 Cinnamic acid derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP disclosed