SCHEMBL4667915

SCHEMBL4667915

Cc1[nH]c2c(F)ccc(C)c2c1CCNC(=O)/C=C/c1ccc2cc[nH]c2c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.43
APP P05067 7/20 0.41
MAPT P10636 7/20 0.41
HDAC2 Q92769 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HDAC4 P56524 1/20 0.37
MEF2D Q14814 1/20 0.37
ACHE P22303 1/20 0.35
PYGL P06737 1/20 0.35
MAOB P27338 1/20 0.35
PTGS2 P35354 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL4754382 1.00 BACE1 (0.43) BACE1APPMAPTHDAC2HDAC3
SCHEMBL4670650 0.93 HDAC2 (0.41) BACE1APPHDAC2HDAC3HDAC1
SCHEMBL4754701 0.93 HDAC2 (0.41) BACE1APPHDAC2HDAC3HDAC1
SCHEMBL4015839 0.87 MEN1 (0.44) APPMAPTMEN1KMT2AHDAC4
SCHEMBL4670737 0.86 HDAC4 (0.46) BACE1MAPTHDAC2HDAC3HDAC1
SCHEMBL4667914 0.86 BACE1 (0.43) BACE1APPMEN1KMT2AACHE
SCHEMBL4017819 0.84 MEN1 (0.47) MAPTHDAC2HDAC3HDAC1MEN1
SCHEMBL4019849 0.83 MEN1 (0.44) BACE1APPMAPTHDAC2HDAC3
SCHEMBL4014345 0.83 MMP1 (0.48) BACE1MEN1KMT2AACHEMAOB
SCHEMBL4017820 0.83 MAPT (0.50) MAPTMEN1KMT2ALMNA

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 5 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
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
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