SCHEMBL4002247

SCHEMBL4002247

COc1ccc(-c2cc3cc(N)ccc3o2)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.61
CYP2C8 P10632 1/20 0.60
PDE4A P27815 2/20 0.54
ABCG2 Q9UNQ0 2/20 0.51
ABCB1 P08183 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HSD17B10 Q99714 2/20 0.50
FYN P06241 1/20 0.50
GLA P06280 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
HPGD P15428 1/20 0.50
TP53 P04637 1/20 0.49
MDM2 Q00987 1/20 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
SCHEMBL17786381 0.81 FYN (0.73) ABCG2ABCB1MEN1KMT2AKDM4E
SCHEMBL11672469 0.80 ABCB1 (0.65) CYP2C8PDE4AABCG2ABCB1MEN1
SCHEMBL7818265 0.79 APP (0.74) APPMAOBNPC1RAB9A
SCHEMBL17667819 0.78 CYP2C8 (0.55) CYP2C8PDE4AABCG2ABCB1MEN1
SCHEMBL4002128 0.78 CYP2C8 (0.76) CYP2C8PDE4AABCG2ABCB1MEN1
SCHEMBL3010742 0.77 CYP2C8 (0.74) CYP2C8PDE4AABCG2ABCB1MEN1
SCHEMBL3013908 0.77 CYP2C8 (0.86) APPCYP2C8PDE4AABCG2ABCB1
SCHEMBL9947483 0.76 MAOB (0.61) APPKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL4005251 0.76 GAPDH (0.55) APPCYP2C8PDE4AABCG2ABCB1
SCHEMBL3008501 0.76 CYP2C8 (0.59) APPCYP2C8PDE4AABCG2ABCB1

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-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