SCHEMBL4288633

SCHEMBL4288633

COc1cc(-c2oc3ccc(CC(=O)Oc4ccccc4F)cc3c2SC)ccc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 7/20 0.42
CSNK2B P67870 7/20 0.42
CSNK2A1 P68400 7/20 0.42
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 4/20 0.39
CYP3A4 P08684 4/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 3/20 0.39
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 2/20 0.39
POLB P06746 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAB9A P51151 1/20 0.39
CREBBP Q92793 1/20 0.39
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 2/20 0.38

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
SCHEMBL4293918 0.92 CSNK2A2 (0.41) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL4288637 0.89 CSNK2A2 (0.43) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL3016629 0.89 CSNK2A2 (0.44) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL3002368 0.86 CSNK2A2 (0.48) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL3001985 0.84 CSNK2A2 (0.43) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL3001735 0.83 ALDH1A1 (0.55) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL3001522 0.82 CSNK2A2 (0.48) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL3009988 0.81 ABCB1 (0.41) MEN1KMT2AMAPTCYP3A4KDM4E
SCHEMBL3007864 0.81 CSNK2A2 (0.47) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A
SCHEMBL4002255 0.81 CSNK2A2 (0.47) CSNK2A2CSNK2BCSNK2A1MEN1KMT2A

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-2069321-B1 NOVEL BENZOFURAN TYPE DERIVATIVES, A COMPOSITION COMPRISING THE SAME FOR TREATING OR PREVENTING COGNITIVE DYSFUNCTION AND THE USE THEREOF MEDIFRON DBT CO LTD (KR) 2016-04-13 EP disclosed
EP-2069321-A1 NOVEL BENZOFURAN TYPE DERIVATIVES, A COMPOSITION COMPRISING THE SAME FOR TREATING OR PREVENTING COGNITIVE DYSFUNCTION AND THE USE THEREOF Digital Biotech Co., Ltd. (KR) 2009-06-17 EP disclosed
WO-2008041826-A1 NOVEL BENZOFURAN TYPE DERIVATIVES, A COMPOSITION COMPRISING THE SAME FOR TREATING OR PREVENTING COGNITIVE DYSFUNCTION AND THE USE THEREOF DIGITAL BIOTECH CO., LTD (KR) 2008-04-10 WO disclosed