SCHEMBL7861410

SCHEMBL7861410

CCOC(=O)C(CCCc1ccccc1)Oc1ccccc1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.49
LMNA P02545 1/20 0.49
PTGER1 P34995 1/20 0.45
PTGER4 P35408 1/20 0.45
PTGER3 P43115 1/20 0.45
PTGER2 P43116 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.44
PPARG P37231 2/20 0.43
PPARA Q07869 1/20 0.43
APP P05067 1/20 0.43
TDP1 Q9NUW8 5/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL9208264 0.93 KMT2A (0.47) L3MBTL1LMNAMRGPRX4PPARGPPARA
SCHEMBL9205464 0.85 L3MBTL1 (0.48) L3MBTL1LMNAMRGPRX4PPARGPPARA
SCHEMBL7860020 0.85 L3MBTL1 (0.53) L3MBTL1LMNAMRGPRX4PPARGPPARA
SCHEMBL1859515 0.82 SMN1; SMN2 (0.46) L3MBTL1LMNAPPARGPPARATDP1
SCHEMBL7861325 0.80 L3MBTL1 (0.57) L3MBTL1LMNAPTGER1MRGPRX4TDP1
SCHEMBL9207231 0.80 ACE (0.47) LMNAPPARGPPARAMAPTSMN1; SMN2
SCHEMBL28840979 0.79 TDP1 (0.48) L3MBTL1PPARGTDP1MAPTKDM4E
SCHEMBL7854550 0.78 PPARG (0.46) L3MBTL1LMNAPPARGPPARATDP1
SCHEMBL7864368 0.77 L3MBTL1 (0.53) L3MBTL1LMNAPTGER1MRGPRX4APP
SCHEMBL10503384 0.77 SMN1; SMN2 (0.46) LMNAPPARGPPARATDP1MAPT

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