SCHEMBL3835642

SCHEMBL3835642

CCOC(=O)Cc1cccc(Br)c1.c1cc2cc(c1)OC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
MAPK1 P28482 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
ALDH1A1 P00352 4/20 0.37
MAPT P10636 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
HPGD P15428 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
CYP19A1 P11511 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL788672 0.83 EGFR (0.48) KDM4EMAPK1SMN1; SMN2EGFRERBB2
SCHEMBL4137771 0.73 EGFR (0.47) KDM4EMAPK1SMN1; SMN2EGFRERBB2
SCHEMBL68412 0.73 L3MBTL1 (0.50) MAPK1SMN1; SMN2ALDH1A1MAPTMEN1
Ethyl Benzoate SCHEMBL27653361 0.73 SMN1; SMN2 (0.47) MAPK1SMN1; SMN2ALDH1A1MAPTMEN1
Fluoride SCHEMBL27313204 0.71 MAPK1 (0.55) KDM4EMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL18945510 0.71 EPHX2 (0.46) MAPK1ALDH1A1MAPTMEN1KMT2A
SCHEMBL28232439 0.70 EGFR (0.48) EGFRERBB2HCAR2NPC1
SCHEMBL20241752 0.70 GLA (0.53) KDM4EMAPK1EGFRERBB2ALDH1A1
SCHEMBL7637921 0.70 EGFR (0.49) EGFRERBB2ALDH1A1MAPTL3MBTL1
SCHEMBL1511063 0.70 CYP4F2 (0.55) EGFRL3MBTL1TDP1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1847524-B1 Terphenyl derivatives for treatment of Alzheimer's disease CELLZOME LTD (GB) 2009-10-14 EP disclosed
EP-1847524-A1 Terphenyl derivatives for treatment of Alzheimer's disease Cellzome (UK) Ltd. (GB) 2007-10-24 EP disclosed