SCHEMBL22381392

SCHEMBL22381392

C=C(C)C(=C)OCCOc1cc(C(=O)OCCOC(=O)C(=C)C)ccc1-c1ccc(-c2ccc(OC(=O)C(=C)C)cc2)cc1CC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ ELANE P08246 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ SCN1A P35498 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ SCN2A Q99250 1/20 0.35
▸ SCN3A Q9NY46 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35
▸ RAD52 P43351 1/20 0.34
▸ RARA P10276 2/20 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
SCHEMBL17485689 0.96 TDP1 (0.39) TDP1POLBAPEX1HTTMAPT
SCHEMBL21254347 0.93 POLB (0.36) TDP1POLBAPEX1HTTMAPT
SCHEMBL20032596 0.92 TDP1 (0.36) TDP1POLBAPEX1HTTMAPT
SCHEMBL22592364 0.91 POLB (0.39) TDP1POLBAPEX1HTTMAPT
SCHEMBL24158065 0.91 TDP1 (0.35) TDP1POLBAPEX1HTTMAPT
SCHEMBL23544524 0.89 TDP1 (0.34) TDP1POLBAPEX1HTTMAPT
SCHEMBL19881906 0.89 TDP1 (0.34) TDP1POLBAPEX1HTTMAPT
SCHEMBL22072003 0.89 POLB (0.39) TDP1POLBAPEX1HTTMAPT
SCHEMBL23919397 0.88 POLB (0.37) TDP1POLBAPEX1HTTMAPT
SCHEMBL21417786 0.87 POLB (0.40) TDP1POLBAPEX1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759997-B2 Polymerizable compound, liquid crystal medium containing same and liquid crystal display device SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-09-01 — — 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-10759997-B2 Polymerizable compound, liquid crystal medium containing same and liquid crystal display device BPHL, KLK3, NEFM TDP1 2192/4885POLB 1544/4885APEX1 4163/4885

“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.

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