SCHEMBL6932555

SCHEMBL6932555

CCCCCCCCCCCCCCCCOc1ccc(OCCCCCCCCCCCCCCCC)cc1

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.79
LTA4H P09960 5/20 0.69
TP53 P04637 2/20 0.68
TSHR P16473 1/20 0.68
PLA2G4B P0C869 3/20 0.66
RARB P10826 3/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
LMNA P02545 1/20 0.61
GAA P10253 1/20 0.61
MAPT P10636 1/20 0.61
ALOX15 P16050 1/20 0.61
HSD17B10 Q99714 1/20 0.61
PLA2G4A P47712 1/20 0.58

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
SCHEMBL3796303 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL11322082 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL28373061 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL8936597 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL5473083 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL1573968 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL2829024 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL11095674 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL10943900 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9771499 1.00 NR5A1 (0.79) NR5A1LTA4HTP53TSHRPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106398214-A Preparation method of polyphenylene sulfide resin for melt-blowing 江苏六鑫洁净新材料有限公司 2017-02-15 CN disclosed
EP-1021391-B1 METHOD FOR C-ALKYLATING HYDROXYLATED AROMATIC COMPOUNDS RHODIA CHIMIE SA (FR) 2003-12-10 EP disclosed
EP-1021391-A1 METHOD FOR C-ALKYLATING HYDROXYLATED AROMATIC COMPOUNDS RHODIA CHIMIE (FR) 2000-07-26 EP disclosed
WO-1997016402-A1 METHOD FOR C-ALKYLATING HYDROXYLATED AROMATIC COMPOUNDS RHODIA CHIMIE (FR) 1997-05-09 WO disclosed