Sugi Predict

Sugi Predict / Compounds / SCHEMBL3751505

SCHEMBL3751505

SCHEMBL3751505

COc1cc(C=O)c(OC)c(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ TSHR P16473 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ PRKDC P78527 2/20 0.53
▸ ERN1 O75460 6/20 0.53
▸ MAPT P10636 3/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ TUBB1 Q9H4B7 1/20 0.45
▸ CYP19A1 P11511 1/20 0.43
▸ NQO2 P16083 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ CA9 Q16790 1/20 0.41
▸ TLR2 O60603 1/20 0.41
▸ TLR1 Q15399 1/20 0.41
▸ TLR6 Q9Y2C9 1/20 0.41

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
SCHEMBL28734008 0.88 ALDH1A1 (0.52) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL2743529 0.85 ALDH1A1 (0.57) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL31419099 0.84 ERN1 (0.47) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL20123251 0.83 ALDH1A1 (0.55) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL5146192 0.83 ALDH1A1 (0.55) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL38661111 0.83 ALDH1A1 (0.55) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL16093496 0.82 ERN1 (0.62) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL5392822 0.82 ALDH1A1 (0.53) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL12672533 0.82 ALDH1A1 (0.53) ALDH1A1KDM4ETSHRTDP1PRKDC
SCHEMBL2743635 0.82 PRKDC (0.58) ALDH1A1KDM4ETSHRTDP1PRKDC

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110849502-B Preparation method of tetramethoxyphenyl zirconium porphyrin nanotube-selenium trioxide nanosheet composite thermosensitive sensing material 浙江理工大学 2021-03-23 — — CN claimed
CN-110849502-A Preparation method of tetramethoxyphenyl zirconium porphyrin nanotube-selenium trioxide nanosheet composite thermosensitive sensing material 浙江理工大学 2020-02-28 — — CN claimed
CN-110724522-A Preparation method of tetramethoxyphenyl manganese porphyrin-Zn-MOF fluorescent material 浙江理工大学 2020-01-24 — — CN claimed
CN-110591700-A Preparation method of tetramethoxyphenyl zirconium porphyrin high-temperature-resistant rare earth metal complex luminescent material 浙江理工大学 2019-12-20 — — CN claimed
CN-1589136-A Pharmaceutical and cosmetic compositions containing aromatic aldehydes bearing oxygen-containing groups CUTANIX CORP (US) 2005-03-02 — — CN claimed
US-20030124157-A1 Compositions containing aromatic aldehydes and their use in treatments ALLERGAN, INC. 2003-07-03 — — US claimed
WO-2024111390-A1 COMPOUND AND METHOD FOR PRODUCING SAME 学校法人帝京大学 2024-05-30 — — WO disclosed
CN-110849502-B Preparation method of tetramethoxyphenyl zirconium porphyrin nanotube-selenium trioxide nanosheet composite thermosensitive sensing material 浙江理工大学 2021-03-23 — — CN disclosed
US-10702515-B2 Compositions containing aromatic aldehydes and their use in treatments ALLERGAN, INC. (US) 2020-07-07 — — US disclosed
CN-110849502-A Preparation method of tetramethoxyphenyl zirconium porphyrin nanotube-selenium trioxide nanosheet composite thermosensitive sensing material 浙江理工大学 2020-02-28 — — CN disclosed
CN-110724522-A Preparation method of tetramethoxyphenyl manganese porphyrin-Zn-MOF fluorescent material 浙江理工大学 2020-01-24 — — CN disclosed
CN-110724522-A Preparation method of tetramethoxyphenyl manganese porphyrin-Zn-MOF fluorescent material 浙江理工大学 2020-01-24 — — CN disclosed
CN-110591700-A Preparation method of tetramethoxyphenyl zirconium porphyrin high-temperature-resistant rare earth metal complex luminescent material 浙江理工大学 2019-12-20 — — CN disclosed
CN-1092414-A Benzylidene derivatives SHIONOGI & CO (JP) 1994-09-21 — — CN disclosed
EP-0403026-A1 12-Substituted-12H-dibenzo(D,G)(1,3)dioxocin-6-carboxylic acids, herbicidal compositions, and a method of controlling undesirable vegetation DowElanco (US) 1990-12-19 — — EP disclosed
CN-86108089-A New tetrahydro isoquinoline derivative — 1987-09-16 — — CN disclosed
EP-0229944-A2 Novel tetrahydroisoquinoline derivatives SYNTEX (U.S.A.) INC. (US) 1987-07-29 — — EP disclosed
US-4681889-A ANGINA, HYPERTENSION, CONGESTIVE HEART FAILURE SYNTEX (U.S.A.) INC. (US) 1987-07-21 — — US disclosed
EP-0210828-A2 Tetrahydroisoquinoline derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them SMITHKLINE BEECHAM CORPORATION (US) 1987-02-04 — — EP disclosed
US-4613606-A CARDIOVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1986-09-23 — — 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 (2 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-10702515-B2 Compositions containing aromatic aldehydes and their use in treatments TYR, ALDH2, AOX1 ALDH1A1 4/4885KDM4E 2261/4885TSHR 4387/4885
US-20030124157-A1 Compositions containing aromatic aldehydes and their use in treatments TYR, ALDH2, AOX1 ALDH1A1 4/4885KDM4E 2261/4885TSHR 4387/4885

“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.