SCHEMBL23908226

SCHEMBL23908226

CCOP(=O)(Cc1cc(CP(=O)(OCC)OCC)c(CP(=O)(OCC)OCC)cc1CP(=O)(OCC)OCC)OCC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
EGFR P00533 2/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.44
PPARD Q03181 1/20 0.43
TP53 P04637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPSR1 Q6W5P4 1/20 0.36
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35
KCNH2 Q12809 1/20 0.35
POLB P06746 3/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
CCNT1 O60563 1/20 0.34
CDK9 P50750 1/20 0.34
ACHE P22303 1/20 0.33

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
SCHEMBL6298909 0.96 TSHR (0.46) TSHREGFRMAPTHTTPPARD
SCHEMBL10022793 0.87 MAPT (0.44) TSHREGFRMAPTHTTPPARD
SCHEMBL12895124 0.85 PGK1 (0.45) TSHREGFRMAPTHTTPPARD
SCHEMBL9172810 0.83 TSHR (0.43) TSHREGFRMAPTHTTPPARD
SCHEMBL3373620 0.83 MAPT (0.44) TSHREGFRMAPTHTTPPARD
SCHEMBL21259132 0.83 EGFR (0.55) TSHREGFRMAPTHTTPPARD
SCHEMBL702504 0.82 NPSR1 (0.47) TSHREGFRMAPTPPARDNPSR1
SCHEMBL6298899 0.81 EGFR (0.43) TSHREGFRMAPTHTTPPARD
SCHEMBL3042909 0.81 TAAR1 (0.43) TSHREGFRMAPTHTTPPARD
SCHEMBL13913134 0.81 TSHR (0.50) TSHREGFRMAPTHTTPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118771995-A Hole transport material, photoelectric conversion element using same, and organic solar cell 京瓷办公信息系统株式会社 2024-10-15 CN disclosed
US-20240334816-A1 HOLE TRANSPORT MATERIAL, AND PHOTOELECTRIC CONVERSION ELEMENT AND ORGANIC SOLAR CELL USING HOLE TRANSPORT MATERIAL KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2024-10-03 US disclosed
US-20210319957-A1 NOVEL COMPOUND, AND COMPOSITION FOR FORMING HOLE TRANSPORTING LAYER FOR PEROVSKITE SOLAR CELLS Tokyo Chemical Industry Co., Ltd. (JP) 2021-10-14 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-20210319957-A1 NOVEL COMPOUND, AND COMPOSITION FOR FORMING HOLE TRANSPORTING LAYER FOR PEROVSKITE SOLAR CELLS SLC43A1, SLC26A3, KCNT1 TSHR 3012/4885EGFR 2426/4885MAPT 3217/4885

“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.