SCHEMBL4670650

SCHEMBL4670650

Cc1[nH]c2c(F)ccc(C)c2c1CCNC(=O)/C=C/c1ccc2[nH]ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 2/20 0.41
BACE1 P56817 4/20 0.41
ACHE P22303 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC4 P56524 1/20 0.37
MEF2D Q14814 1/20 0.37
MAOB P27338 1/20 0.37
PTGS2 P35354 1/20 0.37
APP P05067 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
SCHEMBL4754701 1.00 HDAC2 (0.41) HDAC2BACE1ACHEMEN1KMT2A
SCHEMBL4667915 0.93 BACE1 (0.43) HDAC2BACE1ACHEMEN1KMT2A
SCHEMBL4754382 0.93 BACE1 (0.43) HDAC2BACE1ACHEMEN1KMT2A
SCHEMBL4015839 0.87 MEN1 (0.44) ACHEMEN1KMT2AHDAC4MEF2D
SCHEMBL4670737 0.86 HDAC4 (0.46) HDAC2BACE1MEN1KMT2ADRD2
SCHEMBL4667914 0.86 BACE1 (0.43) BACE1ACHEMEN1KMT2AMAOB
SCHEMBL4017819 0.84 MEN1 (0.47) HDAC2MEN1KMT2AHDAC3HDAC1
SCHEMBL4019849 0.83 MEN1 (0.44) HDAC2BACE1MEN1KMT2AHDAC3
SCHEMBL4014345 0.83 MMP1 (0.48) BACE1ACHEMEN1KMT2AMAOB
SCHEMBL4015068 0.83 MEN1 (0.44) HDAC2MEN1KMT2AHDAC3HDAC1

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