SCHEMBL28028010

SCHEMBL28028010

COCC1Cc2c(C)cc(C)cc2O1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 2/20 0.32
MAOA P21397 3/20 0.32
LMNA P02545 1/20 0.31
SLC6A2 P23975 1/20 0.31
UGT2B17 O75795 2/20 0.30

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
SCHEMBL28027391 0.84 MAOA (0.31) MAOALMNASLC6A2
SCHEMBL28027996 0.76 ALDH1A1 (0.35) ALDH1A1MAPTMAOA
SCHEMBL3601616 0.73 MAOA (0.44) ALDH1A1MAPTMAOA
SCHEMBL14367885 0.72 HRH3 (0.44)
SCHEMBL8251627 0.72 HRH3 (0.44)
SCHEMBL9825767 0.70 SIRT2 (0.32) MAOAUGT2B17
SCHEMBL2643783 0.69 ELAVL3 (0.41) ALDH1A1MAPT
SCHEMBL14449468 0.68 UGT2B17 (0.38) ALDH1A1MAPTMAOAUGT2B17
SCHEMBL8259857 0.68 HRH3 (0.37) ALDH1A1MAOA
SCHEMBL8259889 0.68 CA2 (0.56) LMNA

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
CN-104870429-B Benzofuran derivative, preparation method therefor, and medical application thereof 四川海思科制药有限公司 2017-05-03 CN disclosed
CN-104870429-A Benzofuran derivative, preparation method therefor, and medical application thereof SICHUAN HAISCO PHARMACEUTICAL CO LTD 2015-08-26 CN disclosed