SCHEMBL7069332

SCHEMBL7069332

NC(=O)C=Cc1ccc(C(=O)Cc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
SRD5A2 P31213 2/20 0.53
ESR1 P03372 2/20 0.52
PLAU P00749 2/20 0.49
STS P08842 1/20 0.49
CYP26A1 O43174 1/20 0.47
CYP26B1 Q9NR63 1/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
PGR P06401 1/20 0.44
ESR2 Q92731 1/20 0.44
HDAC3 O15379 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44

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
SCHEMBL7069331 1.00 MAPT (0.54) MAPTL3MBTL1SRD5A2ESR1PLAU
SCHEMBL5694786 0.87 CYP26A1 (0.59) MAPTL3MBTL1SRD5A2ESR1STS
SCHEMBL5694789 0.87 CYP26A1 (0.59) MAPTL3MBTL1SRD5A2ESR1STS
SCHEMBL7069204 0.81 APP (0.51) MAPTL3MBTL1SRD5A2CYP26A1CYP26B1
SCHEMBL7069202 0.81 APP (0.51) MAPTL3MBTL1SRD5A2CYP26A1CYP26B1
SCHEMBL28087116 0.80 AKR1B10 (0.53) MAPTESR1PTGS1PTGS2HDAC3
SCHEMBL4776134 0.80 TBXAS1 (0.55) MAPTESR1PTGS1PTGS2HDAC3
SCHEMBL7129800 0.79 MAPT (0.80) MAPTL3MBTL1SRD5A2PLAUSTS
SCHEMBL5694686 0.79 SRD5A2 (0.58) MAPTL3MBTL1SRD5A2ESR1CYP26A1
SCHEMBL5694698 0.79 SRD5A2 (0.58) MAPTL3MBTL1SRD5A2ESR1CYP26A1

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-1142865-B1 NOVEL 1,2-DIPHENYL-2-PROPEN-1-ONE DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2003-06-18 EP disclosed
US-6395932-B1 AMINOALKYL-1,2-DIPHENYL-2-PROPEN-1-ONE WHICH LOWER INTRAOCULAR PRESSURE BY CAUSING MORPHOLOGICAL CHANGE IN TRABECULAR MESHWORK CELLS. SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-05-28 US disclosed
EP-1142865-A1 NOVEL 1,2-DIPHENYL-2-PROPEN-1-ONE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed