SCHEMBL7071088

SCHEMBL7071088

O=C(O)CCc1ccc(C(=O)Cc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.69
KEAP1 Q14145 1/20 0.68
L3MBTL1 Q9Y468 3/20 0.61
MAPT P10636 1/20 0.61
SRD5A2 P31213 3/20 0.59
FFAR4 Q5NUL3 4/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
HDAC3 O15379 1/20 0.53
MAPK1 P28482 1/20 0.53
ADRA1A P35348 1/20 0.53
HDAC4 P56524 1/20 0.53
SLC6A3 Q01959 1/20 0.53
HDAC1 Q13547 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC8 Q9BY41 1/20 0.53

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
SCHEMBL7129800 0.84 MAPT (0.80) L3MBTL1MAPTSRD5A2NPC1RAB9A
Phenyl Propionic Acid SCHEMBL6534964 0.84 KEAP1 (0.95) FFAR1KEAP1MAPTFFAR4HDAC3
Phenyl Propionic Acid SCHEMBL10575939 0.83 KEAP1 (0.83) FFAR1KEAP1L3MBTL1MAPTFFAR4
SCHEMBL12394493 0.82 FFAR1 (1.00) FFAR1KEAP1MAPTFFAR4HDAC3
Phenyl Propionic Acid SCHEMBL29619843 0.82 KEAP1 (1.00) FFAR1KEAP1MAPTFFAR4HDAC3
Phenyl Propionic Acid SCHEMBL235064 0.82 KEAP1 (1.00) FFAR1KEAP1MAPTFFAR4HDAC3
Phenyl Propionic Acid SCHEMBL13618844 0.82 KEAP1 (1.00) FFAR1KEAP1MAPTFFAR4HDAC3
Phenyl Propionic Acid SCHEMBL3419 0.82 KEAP1 (1.00) FFAR1KEAP1MAPTFFAR4HDAC3
Phenyl Propionic Acid SCHEMBL27523271 0.82 KEAP1 (1.00) FFAR1KEAP1MAPTFFAR4HDAC3
SCHEMBL8896718 0.82 NPC1 (0.59) L3MBTL1MAPTSRD5A2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1179940-C Novel 1,2-diphenyl-2-propen-1-one derivatives ������ҩ��ʽ���� 2004-12-15 CN disclosed
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