SCHEMBL4778992

SCHEMBL4778992

C1=CC(OC2C=CC=CC2(CC2CO2)c2ccccc2)C(CC2CO2)(c2ccccc2)C=C1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
CHRM2 P08172 11/20 0.33
CHRM4 P08173 11/20 0.33
CHRM5 P08912 11/20 0.33
CHRM1 P11229 11/20 0.33
CHRM3 P20309 11/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30

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
SCHEMBL1710870 0.69
SCHEMBL8732311 0.63 MGLL (0.33) TDP1MEN1KMT2A
SCHEMBL11583359 0.62
SCHEMBL1784471 0.62 TSHR (0.33) TDP1MEN1KMT2A
SCHEMBL28040037 0.61 GAA (0.37)
SCHEMBL10640090 0.61 MEN1 (0.31) TDP1MEN1KMT2A
SCHEMBL7145685 0.60 TDP1 (0.41) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL27798852 0.60 TDP1 (0.37) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL9064776 0.60 MEN1 (0.30) TDP1MEN1KMT2A
SCHEMBL6548185 0.59 KDM1A (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008023249-A1 POLYVINYLCHLORIDE COMPOSITION CHEMFIT SPECIALITY CHEMICALS (PTY) LTD (ZA) 2008-02-28 WO disclosed
WO-2008012769-A2 PURGE COMPOSITION AND METHOD OF PURGING AN EXTRUDER CHEMFIT SPECIALITY CHEMICALS (PTY) LTD (ZA) 2008-01-31 WO disclosed
EP-1565518-A1 STABILIZER COMPOSITION FOR FOAMS OF HALOGEN-CONTAINING POLYMERS Baerlocher GmbH (DE) 2005-08-24 EP disclosed
WO-2004048454-A1 STABILIZER COMPOSITION FOR FOAMS OF HALOGEN-CONTAINING POLYMERS BAERLOCHER GMBH (DE) 2004-06-10 WO disclosed
EP-1379582-A1 STABILISER COMBINATION FOR HALOGENATED POLYMERS AND THE USE THEREOF Baerlocher GmbH (DE) 2004-01-14 EP disclosed
US-6569926-B1 Mixture containing epoxy compound and imidazolidone compoound CIBA SPECIALTY CHEMICALS CORPORATION 2003-05-27 US disclosed
US-6531533-B1 Mixtures of polyvinyl chloride and stabilizer agents having colorfastness and improved radiation transparency; used as platisols, porometric materials or coatings CROMPTON VINYL ADDITIVES GMBH (DE) 2003-03-11 US disclosed
WO-2002098964-A1 STABILISER COMBINATION FOR HALOGENATED POLYMERS AND THE USE THEREOF BAERLOCHER GMBH (DE) 2002-12-12 WO disclosed
US-6194494-B1 STABILIZERS FOR POLYVINYL CHLORIDE AGAINST OXIDATION WITCO VINYL ADDITIVES GMBH (DE) 2001-02-27 US disclosed
US-6084013-A MIXTURES OF SUBSTITUTED URACILS OR THIURACILS WITH ALUMINUM CALCIUM HYDROXIDES, PHOSPHITES AND CARBONATES OR THEIR HYDRATES, ALSO LITHIUM LAYERED LATTICE COMPOUNDS AND TITANIUM HYDROTALCITES, FOR POLYVINYL CHLORIDE WITCO VINYL ADDITIVES GMBH (DE) 2000-07-04 US disclosed
US-5925696-A DISCOLORATION INHIBITION FOR POLYVINYL CHLORIDE CIBA SPECIALITY CHEMICALS CORPORATION (US) 1999-07-20 US disclosed