SCHEMBL11991097

SCHEMBL11991097

O=P(c1ccccc1)(c1ccccc1)c1cncc(P(=O)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA5A P35218 1/20 0.39
KCNA5 P22460 3/20 0.38
KCNN4 O15554 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 1/20 0.37
HTT P42858 2/20 0.37
RECQL P46063 1/20 0.37
CFTR P13569 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
ALPG P10696 1/20 0.34
ALOX12 P18054 1/20 0.34
NPY1R P25929 1/20 0.34

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
SCHEMBL14000340 0.82 HTT (0.43) CA2CA4CA5ANPSR1LMNA
SCHEMBL14020774 0.82 KCNA5 (0.42) KCNA5KCNN4ALDH1A1GAA
SCHEMBL12150794 0.81 KCNA5 (0.40) KCNA5KCNN4NPSR1LMNAHTT
SCHEMBL12150777 0.79 NPSR1 (0.43) NPSR1LMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL12150740 0.77 KCNA5 (0.40) KCNA5KCNN4NPSR1LMNAHTT
SCHEMBL133502 0.77 CA2 (0.42) CA2CA4CA5AKCNA5KCNN4
SCHEMBL11282833 0.76 ALDH1A1 (0.46) LMNAHTTKDM4EHSD17B10MAPT
SCHEMBL11991109 0.76 LMNA (0.42) CA2CA4CA5AKCNA5KCNN4
SCHEMBL12150741 0.75 NPSR1 (0.43) NPSR1LMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL14020789 0.75 CYP19A1 (0.39) CA2CA4CA5ANPSR1LMNA

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-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
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

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 CA2 1811/4885CA4 2533/4885CA5A 3325/4885

“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.