SCHEMBL4267544

SCHEMBL4267544

CCOCCCOCCC[O]

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 4/20 0.37
CYP3A4 P08684 1/20 0.34
THRB P10828 2/20 0.32
EPHX2 P34913 1/20 0.32
HTT P42858 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL5176031 1.00 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4THRBEPHX2
SCHEMBL4396035 0.94 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4THRBEPHX2
SCHEMBL10938071 0.94 TSHR (0.42) ALDH1A1TSHRCYP3A4THRBEPHX2
SCHEMBL2400345 0.94 TSHR (0.42) ALDH1A1TSHRCYP3A4THRBEPHX2
SCHEMBL4863 0.94
SCHEMBL4390925 0.92 ALDH1A1 (0.38) ALDH1A1TSHRCYP3A4THRBEPHX2
SCHEMBL21435871 0.92
SCHEMBL4393806 0.89 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4THRBEPHX2
SCHEMBL5175314 0.89 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4THRBEPHX2
SCHEMBL3581454 0.89 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4THRBEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132675-A1 POLYMER HAVING METAL-OXYGEN-METAL BOND AS PRIMARY CHAIN, COMPOSITION THEREOF, SOLID MATERIAL AND PRODUCTION METHOD THEREOF, AND ELECTRONIC COMPONENT AND FIBER TORAY INDUSTRIES, INC. (JP) 2024-04-25 US disclosed
US-9364408-B2 Hair dye agent comprising aminopyrimidine derivatives HENKEL AG & CO. KGAA (DE) 2016-06-14 US disclosed
US-9364407-B2 Hair dye agent comprising aminopyrimidine derivatives HENKEL AG & CO. KGAA (DE) 2016-06-14 US disclosed
US-20150209258-A1 HAIR DYE AGENT COMPRISING AMINOPYRIMIDINE DERIVATIVES HENKEL AG & CO. KGAA (DE) 2015-07-30 US disclosed
US-20150209257-A1 HAIR DYE AGENT COMPRISING AMINOPYRIMIDINE DERIVATIVES HENKEL AG & CO. KGAA (DE) 2015-07-30 US disclosed
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME MITSUI CHEMICALS, INC. (JP) 2009-12-10 US disclosed
US-7605263-B2 Fluorescent naphthalene-1,4,5,8-tetracarboxylic bisimides with an electron-donating substituent on the nucleus INFINEON TECHNOLOGIES AG (DE) 2009-10-20 US disclosed
US-7405030-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2008-07-29 US disclosed
EP-1930339-A2 Imide compound MITSUI CHEMICALS, INC. (JP) 2008-06-11 EP disclosed
US-20070259151-A1 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-11-08 US disclosed
EP-0501167-B1 Liquid dye preparations BASF AG (DE) 1995-07-05 EP disclosed
EP-0656929-A1 USE OF COMPOUNDS WHICH ABSORB AND/OR FLUORESCE IN THE I/R RANGE AS MARKERS FOR LIQUIDS. BASF AG (DE) 1995-06-14 EP disclosed
EP-0645259-A1 Thermal transfer of infrared dye-stuffs BASF Aktiengesellschaft (DE) 1995-03-29 EP disclosed
EP-0628607-A2 Naphthalocyanine BASF Aktiengesellschaft (DE) 1994-12-14 EP disclosed
EP-0619346-A1 Lacquered tris-or tetracationic polymethin dyes BASF Aktiengesellschaft (DE) 1994-10-12 EP disclosed
WO-1994002570-A1 USE OF COMPOUNDS WHICH ABSORB AND/OR FLUORESCE IN THE I/R RANGE AS MARKERS FOR LIQUIDS BASF AKTIENGESELLSCHAFT (DE) 1994-02-03 WO disclosed
US-5282894-A Use of a liquid containing IR dyes as printing ink BASF AKTIENGESELLSCHAFT (DE) 1994-02-01 US disclosed
EP-0553614-A1 Use of infrared dyes containing liquid as a printing ink BASF Aktiengesellschaft (DE) 1993-08-04 EP disclosed
US-5205838-A LIQUID DYE PREPARATIONS: BIS PHENYL-AZO-RESORCINOL IN SOLVENT FOR COLORED RIBBON OR BALL PEN INK BASF AKTIENGESELLSCHAFT (DE) 1993-04-27 US disclosed
EP-0501167-A1 Liquid dye preparations BASF Aktiengesellschaft (DE) 1992-09-02 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 (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-20150209257-A1 HAIR DYE AGENT COMPRISING AMINOPYRIMIDINE DERIVATIVES H1-4, H1-2, QDPR ALDH1A1 72/4885TSHR 3128/4885CYP3A4 2674/4885
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME CACNA1B, KCNN4, KCNN2 ALDH1A1 4231/4885TSHR 3610/4885CYP3A4 2777/4885
US-20150209258-A1 HAIR DYE AGENT COMPRISING AMINOPYRIMIDINE DERIVATIVES KRT18, DPYD, DHFR ALDH1A1 204/4885TSHR 4364/4885CYP3A4 2261/4885

“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.