SCHEMBL12027473

SCHEMBL12027473

c1cc2c(s1)-c1sccc1C21c2ccsc2-c2sccc21

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 1/20 0.38
▸ PTPRC P08575 1/20 0.31

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
SCHEMBL21940539 0.83 PTPRC (0.41) CES1PTPRC
SCHEMBL20838571 0.80 LMNA (0.40) —
SCHEMBL22807704 0.77 CES1 (0.35) CES1
SCHEMBL20846857 0.74 NPC1 (0.40) —
SCHEMBL12027510 0.73 — —
SCHEMBL21939620 0.73 PDK2 (0.41) —
SCHEMBL12027481 0.71 CES1 (0.31) CES1
SCHEMBL9927227 0.71 ESR1 (0.33) CES1
SCHEMBL2008463 0.69 SIGMAR1 (0.30) CES1
SCHEMBL2618046 0.68 CYP2A6 (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10727414-B2 Functional hole transport materials for optoelectronic and/or electrochemical devices ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2020-07-28 — — US disclosed
US-20180190911-A1 FUNCTIONAL HOLE TRANSPORT MATERIALS FOR OPTOELECTRONIC AND/OR ELECTROCHEMICAL DEVICES ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2018-07-05 — — US disclosed
EP-3109912-A1 FUNCTIONAL HOLE TRANSPORT MATERIALS FOR OPTOELECTRONIC AND /OR ELECTROCHEMICAL DEVICES Ecole Polytechnique Fédérale de Lausanne (EPFL) (CH) 2016-12-28 — — EP disclosed
EP-2397475-B1 4, 4' disubstituted 4H-cyclopentadithiophene and new methods for synthesising the same IMEC (BE) 2014-11-12 — — EP disclosed
US-8329923-B2 4, 4′ disubstituted 4H-cyclopentadithiophene and new methods for synthesizing the same IMEC (BE) 2012-12-11 — — US disclosed
US-8329923-B2 4, 4′ disubstituted 4H-cyclopentadithiophene and new methods for synthesizing the same IMEC (BE) 2012-12-11 — — US disclosed
US-20110313175-A1 4, 4' DISUBSTITUTED 4H-CYCLOPENTADITHIOPHENE AND NEW METHODS FOR SYNTHESISING THE SAME UNIVERSITEIT HASSELT (BE) 2011-12-22 — — US disclosed
US-20110313175-A1 4, 4' DISUBSTITUTED 4H-CYCLOPENTADITHIOPHENE AND NEW METHODS FOR SYNTHESISING THE SAME UNIVERSITEIT HASSELT (BE) 2011-12-22 — — US disclosed
EP-2397475-A1 4, 4' disubstituted 4H-cyclopentadithiophene and new methods for synthesising the same IMEC (BE) 2011-12-21 — — 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 (3 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-20180190911-A1 FUNCTIONAL HOLE TRANSPORT MATERIALS FOR OPTOELECTRONIC AND/OR ELECTROCHEMICAL DEVICES SLCO2A1, SLCO4C1, SLCO1A2 CES1 4695/4885PTPRC 3180/4885
US-10727414-B2 Functional hole transport materials for optoelectronic and/or electrochemical devices SLCO2A1, SLCO4C1, SLCO1A2 CES1 4695/4885PTPRC 3180/4885
US-20110313175-A1 4, 4' DISUBSTITUTED 4H-CYCLOPENTADITHIOPHENE AND NEW METHODS FOR SYNTHESISING THE SAME DDT, NISCH, DBH CES1 3296/4885PTPRC 984/4885

“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.

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