SCHEMBL7860020

SCHEMBL7860020

CCOC(=O)C(Cc1ccccc1)Oc1ccccc1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.53
LMNA P02545 1/20 0.53
MRGPRX4 Q96LA9 2/20 0.51
PPARA Q07869 6/20 0.50
PPARG P37231 6/20 0.50
PPARD Q03181 1/20 0.49
MMP8 P22894 1/20 0.47
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPK1 P28482 1/20 0.46
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RXRA P19793 2/20 0.45
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45

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
SCHEMBL9202605 0.92 PPARG (0.50) L3MBTL1LMNAMRGPRX4PPARAPPARG
SCHEMBL7854550 0.87 PPARG (0.46) L3MBTL1LMNAPPARAPPARGMMP8
SCHEMBL9201161 0.86 PPARG (0.51) L3MBTL1LMNAMRGPRX4PPARAPPARG
SCHEMBL9205410 0.86 PPARG (0.50) L3MBTL1LMNAPPARAPPARGMMP8
SCHEMBL7861410 0.85 L3MBTL1 (0.49) L3MBTL1LMNAMRGPRX4PPARAPPARG
SCHEMBL7861325 0.85 L3MBTL1 (0.57) L3MBTL1LMNAMRGPRX4MAPTTDP1
SCHEMBL9205874 0.83 PPARG (0.47) L3MBTL1LMNAMRGPRX4PPARAPPARG
SCHEMBL6716134 0.82 PPARA (0.74) L3MBTL1LMNAPPARAPPARGPPARD
SCHEMBL7864368 0.81 L3MBTL1 (0.53) L3MBTL1LMNAMRGPRX4MAPTTDP1
SCHEMBL9203682 0.81 PPARA (0.51) L3MBTL1LMNAPPARAPPARGPPARD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0625969-B1 ARYLALKOXYPHENOXY-IMIDAZOLINE COMPOUNDS MERRELL PHARMA INC (US) 2001-03-07 EP disclosed
US-5407954-A Serotonin antagonism; treats depression, anxiety, hypertension and migraine headaches MERRELL DOW PHARMACEUTICALS INC. (US) 1995-04-18 US disclosed
EP-0625969-A1 ARYLALKOXYPHENOXY-IMIDAZOLINE COMPOUNDS MERRELL PHARMACEUTICALS INC. (US) 1994-11-30 EP disclosed
WO-1993016051-A1 ARYLALKOXYPHENOXY-IMIDAZOLINE COMPOUNDS MERRELL DOW PHARMACEUTICALS INC. (US) 1993-08-19 WO disclosed
US-5216008-A Antidepressant, anxiolytic, hypotensive and also treats migraine headaches MERRELL DOW PHARMACEUTICALS INC. (US) 1993-06-01 US disclosed