SCHEMBL5834752

SCHEMBL5834752

O=Cc1ccc(-c2ccc(C(F)(F)F)cc2-c2cccc3ccccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 3/20 0.39
▸ SCN9A Q15858 2/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DRD5 P21918 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ PTGDR2 Q9Y5Y4 1/20 0.38
▸ AKR1C3 P42330 1/20 0.37
▸ AKR1C2 P52895 1/20 0.37
▸ KIF11 P52732 1/20 0.37
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP1B1 Q16678 1/20 0.36
▸ CA12 O43570 4/20 0.36
▸ CA1 P00915 4/20 0.36
▸ CA2 P00918 4/20 0.36
▸ CA9 Q16790 4/20 0.36
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL584898 0.79 CA12 (0.53) DRD1DRD2DRD4DRD5DRD3
SCHEMBL16381756 0.77 CA12 (0.56) DRD1DRD2DRD4DRD5DRD3
SCHEMBL16539622 0.77 KIF11 (0.41) DRD1SCN9ADRD5KIF11CYP1A1
SCHEMBL28224945 0.75 KIF11 (0.52) SCN9AHDAC8HDAC6KIF11CA12
SCHEMBL28020022 0.73 GPR3 (0.44) SCN9AKIF11CYP1A1CYP1A2CYP1B1
SCHEMBL4411615 0.73 AKR1C3 (0.57) DRD1SCN9ADRD2DRD4DRD5
SCHEMBL4418949 0.73 APP (0.54) AKR1C3AKR1C2KIF11
SCHEMBL31227778 0.73 AKR1C3 (0.47) DRD1DRD2DRD4DRD5DRD3
SCHEMBL18001814 0.73 KIF11 (0.57) DRD1SCN9ADRD2DRD4DRD5
SCHEMBL17508160 0.73 KIF11 (0.53) DRD1PTGDR2AKR1C3AKR1C2KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7022868-B2 Aminostyrylanthracene compound, synthetic intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2006-04-04 — — US disclosed
US-20050258743-A1 Aminostyrylanthracene compound, synthetic intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2005-11-24 — — US disclosed
US-6906217-B2 Aminostyrylanthracene compound, synthetic intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2005-06-14 — — US disclosed
US-6790975-B2 ORGANIC ELECTROLUMINESCENCE; CONDENSATION FROM A CORRESPONDING AMINOBENZALDEHYDE AND A PHOSPHONIC ESTER OR PHOSPHONIUM SALT; YELLOW TO RED LIGHT SONY CORPORATION (JP) 2004-09-14 — — US disclosed
US-20030229242-A1 Aminostyrylanthracene compound, synthetic intermediate thereof, and process for production thereof JOLED INC. (JP) 2003-12-11 — — US disclosed
US-20030208089-A1 Aminostyrylanthrancene compound, synthetic intermediate thereof, and process for production thereof JOLED INC. (JP) 2003-11-06 — — US disclosed
US-20030149290-A1 AMINOSTYRYLANTHRACENE COMPOUND, SYNTHETIC INTERMEDIATE THEREOF, AND PROCESS FOR PRODUCTION THEREOF JOLED INC. (JP) 2003-08-07 — — US disclosed
EP-1191015-A1 AMINOSTYRYLANTHRACENE COMPOUNDS, INTERMEDIATES FOR THE PREPARATION THEREOF, AND PROCESSES FOR THE PREPARATION OF BOTH Sony Corporation (JP) 2002-03-27 — — 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 (4 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-20050258743-A1 Aminostyrylanthracene compound, synthetic intermediate thereof, and process for production thereof AASDHPPT, AADAT, ALDH7A1 DRD1 2543/4885SCN9A 1834/4885DRD2 2376/4885
US-20030229242-A1 Aminostyrylanthracene compound, synthetic intermediate thereof, and process for production thereof AASDHPPT, AADAT, ALDH7A1 DRD1 2068/4885SCN9A 1898/4885DRD2 2463/4885
US-20030149290-A1 AMINOSTYRYLANTHRACENE COMPOUND, SYNTHETIC INTERMEDIATE THEREOF, AND PROCESS FOR PRODUCTION THEREOF AASDHPPT, AADAT, ALDH7A1 DRD1 2068/4885SCN9A 1898/4885DRD2 2463/4885
US-20030208089-A1 Aminostyrylanthrancene compound, synthetic intermediate thereof, and process for production thereof AASDHPPT, ALDH7A1, AGPAT5 DRD1 1982/4885SCN9A 1503/4885DRD2 2978/4885

“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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