SCHEMBL7071029

SCHEMBL7071029

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

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.59
CYP4A11 Q02928 2/20 0.59
MAPT P10636 4/20 0.58
TDP1 Q9NUW8 2/20 0.57
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 1/20 0.52
ABCB1 P08183 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.50
ALOX5 P09917 1/20 0.50
EPHX2 P34913 1/20 0.50
LMNA P02545 1/20 0.50
SRD5A2 P31213 2/20 0.49

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
Ethyl 3-Phenylpropanoate SCHEMBL304816 0.86 TDP1 (0.75) CYP4F2CYP4A11MAPTTDP1ALDH1A1
SCHEMBL12065155 0.85 NPC1 (0.55) CYP4F2CYP4A11MAPTTDP1NPC1
SCHEMBL8896718 0.85 NPC1 (0.59) CYP4F2CYP4A11MAPTTDP1NPC1
Ethyl 3-Phenylpropanoate SCHEMBL7440447 0.85 TDP1 (0.72) CYP4F2CYP4A11MAPTTDP1ALDH1A1
SCHEMBL2773061 0.83 CYP4F2 (0.68) CYP4F2CYP4A11TDP1ABCB1ALOX5
SCHEMBL14028452 0.82 CYP4F2 (0.66) CYP4F2CYP4A11MAPTTDP1NPC1
Ethyl 3-Phenylpropanoate SCHEMBL3322728 0.82 CYP4F2 (0.70) CYP4F2CYP4A11MAPTTDP1ALDH1A1
Ethyl 3-Phenylpropanoate SCHEMBL311047 0.82 TDP1 (0.68) CYP4F2CYP4A11TDP1ABCB1L3MBTL1
Ethyl 3-Phenylpropanoate SCHEMBL28983325 0.82 TDP1 (0.68) CYP4F2CYP4A11MAPTTDP1ALDH1A1
Ethyl 3-Phenylpropanoate SCHEMBL27762292 0.82 TDP1 (0.68) CYP4F2CYP4A11MAPTTDP1ALDH1A1

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
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
CN-1336910-A Novel 1,2-diphenyl-2-propen-1-one derivatives SANTEN PHARMACEUTICAL CO LTD (JP) 2002-02-20 CN disclosed
EP-1142865-A1 NOVEL 1,2-DIPHENYL-2-PROPEN-1-ONE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed