SCHEMBL934079

SCHEMBL934079

O=C(Cl)C(=O)c1cc(C(=O)Cl)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ALDH1A1 P00352 6/20 0.39
TP53 P04637 1/20 0.39
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
HDAC8 Q9BY41 1/20 0.38
SRD5A2 P31213 1/20 0.36
KMO O15229 2/20 0.35
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
VCAM1 P19320 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL9618406 0.85 TSHR (0.45) TSHRALDH1A1TP53CES2CES1
SCHEMBL29514652 0.76 TSHR (0.67) TSHRSRD5A2KMOMAPTKDM4E
SCHEMBL110094 0.76 TSHR (0.67) TSHRSRD5A2KMOMAPTKDM4E
SCHEMBL7608864 0.73 TSHR (0.47) TSHRALDH1A1TP53CES2CES1
SCHEMBL3566736 0.72 TSHR (0.50) TSHRALDH1A1SRD5A2KMOMAPT
SCHEMBL101687 0.72 TSHR (0.45) TSHRALDH1A1SRD5A2KMOMAPT
SCHEMBL29440655 0.72 ALDH1A1 (0.40) TSHRALDH1A1TP53CES2CES1
SCHEMBL75886 0.72 ALDH1A1 (0.40) TSHRALDH1A1TP53CES2CES1
SCHEMBL11806931 0.71 TSHR (0.43) TSHRALDH1A1SRD5A2KMOMAPT
SCHEMBL2964948 0.71 TSHR (0.43) TSHRALDH1A1SRD5A2KMOMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2448657-A2 IMPROVED HYBRID TFC RO MEMBRANES WITH NITROGEN ADDITIVES NanoH2O Inc. (US) 2012-05-09 EP disclosed
WO-2011008549-A2 IMPROVED HYBRID TFC RO MEMBRANES WITH NITROGEN ADDITIVES NanoH2O Inc. (US) 2011-01-20 WO disclosed
WO-2010123518-A1 IMPROVED TFC MEMBERANES WITH NANOPARTICLES AND OTHER ADDITIVES NANOH2O, INC. (US) 2010-10-28 WO disclosed
WO-2010120327-A1 IMPROVED TFC MEMBRANES WITH HYDROLYZED AND OTHER ADDITIVES NANOH2O, INC. (US) 2010-10-21 WO disclosed
WO-2010120326-A1 IMPROVED TFC MEMBRANES WITH HYDROLIZED ADDITIVES NANOH2O, INC. (US) 2010-10-21 WO disclosed
WO-2010120325-A1 IMPROVED TFC MEMBRANES WITH ALKALINE EARTH METAL AND OTHER ADDITIVES NANOH2O, INC. (US) 2010-10-21 WO disclosed
US-6444091-B1 MIXING PULPS WITH POLYAMIDES OR IN COMBINATION WITH COAGULANTS, FLOCCULANTS AND/OR PARTICLES; EFFICIENCY NALCO CHEMICAL COMPANY 2002-09-03 US disclosed