SCHEMBL9853727

SCHEMBL9853727

Cc1cc(O)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.44
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
TYR P14679 1/20 0.41
ESR1 P03372 1/20 0.40
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
TSHR P16473 3/20 0.37
HTR2A P28223 3/20 0.37
HTR2C P28335 3/20 0.37
HTR2B P41595 3/20 0.37
SLC6A2 P23975 6/20 0.37
SLC6A4 P31645 5/20 0.37
SLC6A3 Q01959 5/20 0.37
SCN4A P35499 1/20 0.37
CYTH2 Q99418 1/20 0.36
CYP1A2 P05177 3/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2D6 P10635 3/20 0.36
CHRM1 P11229 2/20 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
SCHEMBL9297488 0.79 ALDH1A1 (0.41) IDO1TDO2PPARGPPARATSHR
SCHEMBL9298647 0.79 IDO1 (0.44) IDO1TDO2SLC6A2SLC6A4SLC6A3
SCHEMBL4480102 0.77 SLC6A2 (0.53) IDO1TDO2ESR1TSHRHTR2A
SCHEMBL12841456 0.77 NOS2 (0.50) TSHRHTR2AHTR2CHTR2BSLC6A2
SCHEMBL6823348 0.77 NOS2 (0.50) TSHRHTR2AHTR2CHTR2BSLC6A2
SCHEMBL6823741 0.76 SLC6A2 (0.41) ESR2TYRPPARGPPARATSHR
SCHEMBL3716834 0.76 HTR2B (0.42) ESR2ESR1TSHRHTR2AHTR2C
SCHEMBL8082370 0.75 SLC6A4 (0.71) TSHRHTR2AHTR2CHTR2BSLC6A2
SCHEMBL4623634 0.75 SLC6A4 (0.71) TSHRHTR2AHTR2CHTR2BSLC6A2
SCHEMBL30501482 0.75 SLC6A4 (0.71) TSHRHTR2AHTR2CHTR2BSLC6A2

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-0446722-A1 Novel hydroxylated phenoxy compounds and process for their preparation Bromine Compounds Ltd. (IL) 1991-09-18 EP claimed
EP-0446722-A1 Novel hydroxylated phenoxy compounds and process for their preparation Bromine Compounds Ltd. (IL) 1991-09-18 EP disclosed