SCHEMBL4762963

SCHEMBL4762963

O=P(c1ccccc1)(c1ccccc1)c1ccccc1P(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.52
NPSR1 Q6W5P4 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HTT P42858 2/20 0.52
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA5A P35218 1/20 0.50
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.45
APOBEC3A P31941 1/20 0.44
CASP6 P55212 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
CFTR P13569 1/20 0.44
MAPT P10636 2/20 0.42
GAA P10253 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALPG P10696 1/20 0.42

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
SCHEMBL14020795 0.87 NPSR1 (0.52) POLBNPSR1ALDH1A1HTTCA2
SCHEMBL134314 0.87 POLB (0.47) POLBNPSR1ALDH1A1HTTCA2
SCHEMBL14020801 0.86 CA2 (0.48) POLBNPSR1ALDH1A1HTTCA2
SCHEMBL134306 0.85 NPSR1 (0.50) POLBNPSR1ALDH1A1HTTCA2
Triphenylphosphine Oxide SCHEMBL3949 0.84 CA2 (0.58) NPSR1ALDH1A1HTTCA2CA4
Triphenylphosphine Oxide SCHEMBL513223 0.84 CA2 (0.58) NPSR1ALDH1A1HTTCA2CA4
SCHEMBL780209 0.83 POLB (0.44) POLBNPSR1ALDH1A1HTTCA2
SCHEMBL31207462 0.83 ALDH1A1 (0.44) POLBNPSR1ALDH1A1HTTCA2
SCHEMBL7638842 0.83 POLB (0.44) POLBNPSR1ALDH1A1HTTCA2
SCHEMBL29539230 0.83 CYP3A4 (0.56) POLBNPSR1ALDH1A1HTTCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117143104-A Pyrrolo [1,2-a ] quinoxaline compound synthesized from nitropyrrole aromatic hydrocarbon and carbon dioxide and synthesis method thereof 陕西科技大学 2023-12-01 CN claimed
CN-114573438-A Mono-fluorine chlorine/bromoacetone compound and preparation method thereof 上海应用技术大学 2022-06-03 CN disclosed
CN-114127050-A Benzopyran and imidazole derivatives useful for stabilizing amyloidogenic immunoglobulin light chains 斯克利普斯研究所 2022-03-01 CN disclosed
US-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 US disclosed
US-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 US disclosed
EP-2463929-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL USING SAME Mitsubishi Chemical Corporation (JP) 2012-06-13 EP disclosed
US-20080241589-A1 ORGANIC ELECTROLUMINESCENT DEVICE FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed
US-20080241589-A1 ORGANIC ELECTROLUMINESCENT DEVICE FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed
US-20080238307-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed
US-20080238307-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed
US-20080241518-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT UDC IRELAND LIMITED (IE) 2008-10-02 US disclosed
US-20080241518-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT UDC IRELAND LIMITED (IE) 2008-10-02 US disclosed
JP-2008184408-A ORGANOMETALLIC COMPLEX AND METHOD FOR PRODUCING ALDOL ADDUCT UNIV NAGOYA 2008-08-14 JP disclosed
US-4902833-A Bisphosphine dioxides UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) 1990-02-20 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-20080241589-A1 ORGANIC ELECTROLUMINESCENT DEVICE OR10J3, AOC2, L1CAM POLB 703/4885NPSR1 4652/4885ALDH1A1 196/4885

“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.