Sugi Predict

Sugi Predict / Compounds / SCHEMBL9105115

SCHEMBL9105115

SCHEMBL9105115

C=C(C)C(=O)OCCCCCCOc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.92

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.92
▸ POLB P06746 1/20 0.92
▸ APEX1 P27695 1/20 0.92
▸ TDP1 Q9NUW8 1/20 0.92
▸ RARB P10826 5/20 0.66
▸ TP53 P04637 1/20 0.58
▸ TSHR P16473 1/20 0.58
▸ PLA2G4B P0C869 6/20 0.57
▸ GAA P10253 1/20 0.53
▸ PLA2G4A P47712 1/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50

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
SCHEMBL10428461 0.96 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL8678901 0.96 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL9952684 0.96 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL10428187 0.96 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL1309117 0.96 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL8682933 0.96 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL8962574 0.96 HTT (1.00) HTTPOLBAPEX1TDP1RARB
Biphenyl SCHEMBL1493814 0.95 HTT (0.87) HTTPOLBAPEX1TDP1RARB
SCHEMBL11467186 0.94 HTT (0.97) HTTPOLBAPEX1TDP1RARB
Hydrochloric Acid SCHEMBL6450158 0.94 HTT (0.97) HTTPOLBAPEX1TDP1RARB

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
CN-115916853-B Polymer, and photo-alignment film and retardation film using the same 大阪有机化学工业株式会社 2024-07-09 — — CN disclosed
WO-2023171757-A1 POLYMER COMPOSITION, SINGLE LAYER PHASE DIFFERENCE MATERIAL, AND LIQUID CRYSTAL ALIGNMENT AGENT 日産化学株式会社 2023-09-14 — — WO disclosed
WO-2023171760-A1 PHASE DIFFERENCE FILM COMPOSITION AND SINGLE-LAYER PHASE DIFFERENCE MATERIAL 日産化学株式会社 2023-09-14 — — WO disclosed
WO-2023095925-A1 POLYMER COMPOSITION AND SINGLE-LAYER RETARDATION MATERIAL 日産化学株式会社 2023-06-01 — — WO disclosed
CN-115916853-A Novel polymer, and photo-alignment film and retardation film using same 大阪有机化学工业株式会社 2023-04-04 — — CN disclosed
WO-2017170681-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学工業株式会社 2017-10-05 — — WO disclosed
US-20120298932-A1 METAL COMPLEX, COMPOSITION COMPRISING SAME AND LIGHT-EMITTING ELEMENT USING SAME TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-11-29 — — US disclosed
EP-2460788-A1 METAL COMPLEX, COMPOSITION COMPRISING SAME AND LIGHT-EMITTING ELEMENT USING SAME Sumitomo Chemical Company, Limited (JP) 2012-06-06 — — 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 (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-20120298932-A1 METAL COMPLEX, COMPOSITION COMPRISING SAME AND LIGHT-EMITTING ELEMENT USING SAME C1S, AP3M1, AP1M1 HTT 3049/4885POLB 3800/4885APEX1 308/4885

“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.