SCHEMBL9490087

SCHEMBL9490087

O=C1CC(Cl)=C(Cl)C(Cl)=C1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.37
BCHE P06276 2/20 0.37
ACHE P22303 2/20 0.37
CES1 P23141 2/20 0.37
NSD2 O96028 1/20 0.37
UCHL1 P09936 1/20 0.35
UCHL3 P15374 1/20 0.35
ECE1 P42892 1/20 0.35
MUS81 Q96NY9 1/20 0.35
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ALOX12 P18054 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL28464858 0.87
SCHEMBL2591478 0.79
SCHEMBL5432883 0.75
SCHEMBL6006346 0.65 CES2 (0.40) CES2BCHEACHECES1NSD2
SCHEMBL9242978 0.56
SCHEMBL1892002 0.55
SCHEMBL79009 0.55 CES2 (1.00) CES2BCHEACHECES1NSD2
SCHEMBL21327556 0.55 CES2 (0.90) CES2BCHEACHECES1NSD2
Chloranil SCHEMBL4682884 0.50 CES2 (1.00) CES2BCHEACHECES1NSD2
Chloranil SCHEMBL24049 0.50 CES2 (1.00) CES2BCHEACHECES1NSD2

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-0262061-B1 PROCESS FOR STABILIZING CHLORINATION MIXTURES OF PHENOL AND/OR CHLOROPHENOLS RHONE-POULENC CHIMIE (FR) 1993-02-24 EP disclosed
EP-0262062-B1 PROCESS FOR PREPARING CHLOROPHENOLS RHONE-POULENC CHIMIE (FR) 1989-08-23 EP disclosed
US-4853153-A USING REDUCING AGENT AND CHLORINATED CYCLIC KETONE RHONE-POULENC CHIMIE (FR) 1989-08-01 US disclosed
EP-0262062-A1 Process for preparing chlorophenols RHONE-POULENC CHIMIE (FR) 1988-03-30 EP disclosed
EP-0262061-A2 Process for stabilizing chlorination mixtures of phenol and/or chlorophenols RHONE-POULENC CHIMIE (FR) 1988-03-30 EP disclosed