SCHEMBL4957321

SCHEMBL4957321

C=CCOc1cccc(-c2cccc(F)c2)c1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HTR2A P28223 3/20 0.38
HTR2C P28335 3/20 0.38
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
FYN P06241 1/20 0.37
HTR1A P08908 1/20 0.37
SQOR Q9Y6N5 1/20 0.36
LIG1 P18858 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
GCGR P47871 1/20 0.35
MAPK14 Q16539 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL4624362 0.78 MAPT (0.46) MAPTL3MBTL1HTR2AHTR2CTSHR
SCHEMBL515196 0.74 ADRB2 (0.59) L3MBTL1TSHRHPGDMAPK1HSD17B10
SCHEMBL28538422 0.74 HPGD (0.46) MAPTL3MBTL1HTR2ATSHRHPGD
SCHEMBL8637602 0.74 LIG1 (0.44) MAPTL3MBTL1HTR2ATSHRHPGD
SCHEMBL28547488 0.74 HPGD (0.43) MAPTL3MBTL1HTR2ATSHRHPGD
SCHEMBL20454563 0.73 HPGD (0.47) MAPTL3MBTL1HTR2ATSHRHPGD
SCHEMBL22085950 0.73 ADRB2 (0.44) MAPTL3MBTL1TSHRHPGDMAPK1
SCHEMBL5611931 0.72 ADRB2 (0.47) MAPTL3MBTL1TSHRHPGDMAPK1
SCHEMBL7764770 0.70 HPGD (0.55) HTR2ATSHRHPGDMAPK1HSD17B10
SCHEMBL13685109 0.70 DRD1 (0.50) L3MBTL1MAPK1ADRB2ADRB1

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-1874756-A1 CHROMANE AND CHROMENE DERIVATIVES AND USES THEREOF Wyeth (US) 2008-01-09 EP disclosed
WO-2006116165-A1 CHROMANE AND CHROMENE DERIVATIVES AND USES THEREOF WYETH (US) 2006-11-02 WO disclosed