SCHEMBL264188

SCHEMBL264188

CCOC(=S)SC(C(=O)O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
MMP8 P22894 1/20 0.44
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP2D6 P10635 1/20 0.41
PIN1 Q13526 1/20 0.41
GAA P10253 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB2 P47870 2/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PKM P14618 1/20 0.40
LMNA P02545 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ABCB11 O95342 1/20 0.40
GABRA2 P47869 1/20 0.40

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
SCHEMBL11847739 0.84 KDM4E (0.38) KDM4EALDH1A1CYP2D6CYP1A2CYP3A4
SCHEMBL11840131 0.83 MAPT (0.43) KDM4ETSHRALDH1A1CYP1A2CYP3A4
SCHEMBL261848 0.79 MMP8 (0.44) KDM4EMMP8TSHRALDH1A1CYP2D6
SCHEMBL13358859 0.77 MMP8 (0.40) KDM4EMMP8TSHRALDH1A1CYP2D6
SCHEMBL12892652 0.77 KDM4E (0.50) KDM4EMMP8TSHRALDH1A1PIN1
SCHEMBL13873960 0.76 CYP2D6 (0.43) ALDH1A1CYP2D6SMN1; SMN2PKMLMNA
SCHEMBL11838855 0.76 CYP1A2 (0.40) CYP1A2LMNAMAPT
SCHEMBL11780897 0.75 KDM4E (0.57) KDM4EMMP8TSHRPIN1GAA
SCHEMBL28870213 0.75 KDM4E (0.48) KDM4EMMP8TSHRALDH1A1PIN1
SCHEMBL28870216 0.75 KDM4E (0.48) KDM4EMMP8TSHRALDH1A1PIN1

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2443485-B1 BIOMEDICAL DEVICES BAUSCH & LOMB (US) 2017-11-08 EP disclosed
EP-2443486-B1 BIOMEDICAL DEVICES BAUSCH & LOMB (US) 2017-03-01 EP disclosed
EP-2443482-B1 BIOMEDICAL DEVICES, POLYMERIC MATERIALS AND CONTACT LENSES COMPRISING THE SAME. BAUSCH & LOMB (US) 2017-03-01 EP disclosed
EP-1781605-B2 POLYMERS PRODUCED BY USING SULPHUR COMPOUNDS IN THE FORM OF TRANSFER AGENTS FOR CONTROLLED RADICAL POLYMERISATION OF ACRYLIC ACID AND THE USE THEREOF COATEX SAS (FR) 2015-04-01 EP disclosed
US-8470750-B2 Trithiocarbonate derivatives and the use thereof in the form of transfer agents for acrylic acid controlled radical polymerisation COATEX S.A.S (FR) 2013-06-25 US disclosed
US-8470750-B2 Trithiocarbonate derivatives and the use thereof in the form of transfer agents for acrylic acid controlled radical polymerisation COATEX S.A.S (FR) 2013-06-25 US disclosed
US-20120259083-A1 TRITHIOCARBONATE DERIVATIVES AND THE USE THEREOF IN THE FORM OF TRANSFER AGENTS FOR ACRYLIC ACID CONTROLLED RADICAL POLYMERISATION COATEX S.A.S. (FR) 2012-10-11 US disclosed
US-20120259083-A1 TRITHIOCARBONATE DERIVATIVES AND THE USE THEREOF IN THE FORM OF TRANSFER AGENTS FOR ACRYLIC ACID CONTROLLED RADICAL POLYMERISATION COATEX S.A.S. (FR) 2012-10-11 US disclosed
US-8227633-B2 Trithiocarbonate derivatives and the use thereof in the form of transfer agents for acrylic acid controlled radical polymerisation COATEX S.A.S. (FR) 2012-07-24 US disclosed
US-8227633-B2 Trithiocarbonate derivatives and the use thereof in the form of transfer agents for acrylic acid controlled radical polymerisation COATEX S.A.S. (FR) 2012-07-24 US disclosed
US-20100317816-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-20100317816-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-20100317817-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-20100317817-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-7851572-B2 Polymers produced by using sulphur compounds in the form of transfer agents for controlled radical polymerisation of acrylic acid and the use thereof COATEX S.A.S. (FR) 2010-12-14 US disclosed
US-7851572-B2 Polymers produced by using sulphur compounds in the form of transfer agents for controlled radical polymerisation of acrylic acid and the use thereof COATEX S.A.S. (FR) 2010-12-14 US disclosed
US-20070197747-A1 Polymers Produced By Using Sulphur Compounds In The Form Of Transfer Agents For Controlled Radical Polymerisation Of Acrylic Acid And The Use Thereof COATEX S.A.S. (FR) 2007-08-23 US disclosed
US-20070197747-A1 Polymers Produced By Using Sulphur Compounds In The Form Of Transfer Agents For Controlled Radical Polymerisation Of Acrylic Acid And The Use Thereof COATEX S.A.S. (FR) 2007-08-23 US disclosed
US-20070179262-A1 Trithiocarbonate derivatives and the use thereof in the form of transfer agents for acrylic acid controlled radical polymerisation COATEX S.A.S. (FR) 2007-08-02 US disclosed
US-20070179262-A1 Trithiocarbonate derivatives and the use thereof in the form of transfer agents for acrylic acid controlled radical polymerisation COATEX S.A.S. (FR) 2007-08-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070179262-A1 Trithiocarbonate derivatives and the use thereof in the form of transfer agents for acrylic acid controlled radical polymerisation TST, AS3MT, TTPA KDM4E 4504/4885MMP8 4570/4885TSHR 1032/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.