SCHEMBL1633925

SCHEMBL1633925

COCCOCCOCCOCC1COc2cscc2O1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 2/20 0.33
CYP2D6 P10635 3/20 0.32
S1PR1 P21453 2/20 0.32
SGPL1 O95470 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 2/20 0.30
CYP2C19 P33261 2/20 0.30
KMT2A Q03164 2/20 0.30
HTR1A P08908 3/20 0.30
ADRA1D P25100 3/20 0.30
ADRA1A P35348 3/20 0.30
ADRA1B P35368 3/20 0.30
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
THPO P40225 1/20 0.30
ADRA2A P08913 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
SCHEMBL28676828 1.00 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2TSHRCYP2D6S1PR1
SCHEMBL23822909 1.00 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2TSHRCYP2D6S1PR1
SCHEMBL14748770 0.99 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2TSHRCYP2D6S1PR1
SCHEMBL20348449 0.89 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2CYP2D6S1PR1SGPL1
SCHEMBL13321811 0.89 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2CYP2D6S1PR1SGPL1
SCHEMBL14188552 0.87 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2CYP2D6S1PR1SGPL1
SCHEMBL13321812 0.86 CYP2D6 (0.32) ALDH1A1CYP2D6S1PR1SGPL1CYP2C19
SCHEMBL31516452 0.86 ALDH1A1 (0.34) ALDH1A1CYP2D6S1PR1SGPL1MEN1
SCHEMBL2847714 0.86 ALDH1A1 (0.32) ALDH1A1CYP2D6
SCHEMBL31516457 0.86 ALDH1A1 (0.32) ALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932320-B2 Process for preparing electroconductive coatings AGFA-GEVAERT, N.V. (BE) 2011-04-26 US claimed
US-7378039-B2 Aqueous or non-aqueous solution or dispersion of a polythiophene or thiophene copolymer AGFA-GEVAERT (BE) 2008-05-27 US claimed
US-20080017833-A1 Process for Preparing Electroconductive Coatings AGFA-GEVAERT (BE) 2008-01-24 US claimed
EP-1458785-B1 3,4-ALKYLENEDIOXY-THIOPHENE COPOLYMERS AGFA GEVAERT (BE) 2007-05-09 EP claimed
EP-1453877-B1 PROCESS FOR PREPARING AN AQUEOUS OR NON-AQUEOUS SOLUTION OR DISPERSION OF A POLYTHIOPHENE OR THIOPHENE COPOLYMER AGFA GEVAERT (BE) 2007-03-28 EP claimed
US-7048874-B2 Process for preparing an aqueous or non-aqueous solution or dispersion of a polythionphene or thiophene copolymer AGFA-GEVAERT (BE) 2006-05-23 US claimed
US-6995223-B2 3,4-alkylenedioxy-thiophene copolymers AGFA-GEVAERT (BE) 2006-02-07 US claimed
US-6927298-B2 3,4-alkylenedioxythiophenedioxide compounds and polymers comprising monomeric units thereof AGFA-GEVAERT (BE) 2005-08-09 US claimed
US-20040260016-A1 Process for preparing electroconductive coatings AGFA-GEVAERT (BE) 2004-12-23 US claimed
US-20040097741-A1 3,4-alkylenedioxythiophenedioxide compounds and polymers comprising monomeric units thereof AGFA-GEVAERT (BE) 2004-05-20 US claimed
US-20030211331-A1 Process for preparing an aqueous or non-aqueous solution or dispersion of a polythionphene or thiophene copolymer AGFA-GEVAERT (BE) 2003-11-13 US claimed
US-20030149171-A1 3,4-alkylenedioxy-thiophene copolymers AGFA-GEVAERT (BE) 2003-08-07 US claimed
EP-1323764-A1 Process for preparing an aqueous solution or dispersion of a polythiophene or thiophene copolymer Agfa-Gevaert (BE) 2003-07-02 EP claimed
EP-1323763-A1 3,4-Alkylenedioxy-thiophene copolymers Agfa-Gevaert (BE) 2003-07-02 EP claimed
US-7932320-B2 Process for preparing electroconductive coatings AGFA-GEVAERT, N.V. (BE) 2011-04-26 US disclosed
US-7378039-B2 Aqueous or non-aqueous solution or dispersion of a polythiophene or thiophene copolymer AGFA-GEVAERT (BE) 2008-05-27 US disclosed
US-7378039-B2 Aqueous or non-aqueous solution or dispersion of a polythiophene or thiophene copolymer AGFA-GEVAERT (BE) 2008-05-27 US disclosed
US-20030149171-A1 3,4-alkylenedioxy-thiophene copolymers AGFA-GEVAERT (BE) 2003-08-07 US disclosed
EP-1323764-A1 Process for preparing an aqueous solution or dispersion of a polythiophene or thiophene copolymer Agfa-Gevaert (BE) 2003-07-02 EP disclosed
EP-1323763-A1 3,4-Alkylenedioxy-thiophene copolymers Agfa-Gevaert (BE) 2003-07-02 EP 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-20040097741-A1 3,4-alkylenedioxythiophenedioxide compounds and polymers comprising monomeric units thereof ADH1C, ADH1A, SCO2 ALDH1A1 15/4885SMN1; SMN2 4193/4885TSHR 2640/4885

“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.