Sugi Predict

Sugi Predict / Compounds / SCHEMBL4868417

SCHEMBL4868417

SCHEMBL4868417

C[Si](C)(CCc1ccccc1)O[Si](C)(C)CCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ ALOX12 P18054 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TAAR1 Q96RJ0 3/20 0.41
▸ ATM Q13315 1/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ LOXL2 Q9Y4K0 1/20 0.41
▸ KCNH2 Q12809 1/20 0.40
▸ IDO1 P14902 1/20 0.39
▸ AOC3 Q16853 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38

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
SCHEMBL18050 0.91 TDP1 (0.43) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL20382909 0.91 TDP1 (0.43) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL21369187 0.90 TDP1 (0.41) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL20365397 0.90 TDP1 (0.41) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL4745438 0.87 IDO1 (0.45) HTR2AKCNH2IDO1AOC3MAOA
SCHEMBL10535412 0.86 TDP1 (0.39) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL7063056 0.86 TDP1 (0.39) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL104981 0.84 TDP1 (0.44) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL20365392 0.83 TDP1 (0.36) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL20365395 0.83 TDP1 (0.36) TDP1ALDH1A1HPGDALOX15ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4283591-A — — None — — JP disclosed
CN-110577506-B Method for synthesizing ester derivative of (-cephalotaxine) and intermediate thereof 中国科学院上海有机化学研究所 2023-04-07 — — CN disclosed
CN-115793392-A White solder resist dry film with good yellowing resistance and preparation method thereof 广东硕成科技股份有限公司 2023-03-14 — — CN disclosed
CN-114341993-A Optimized analyte derivatization with crystal sponge method 默克专利有限公司 2022-04-12 — — CN disclosed
US-10005797-B2 Hydrosilylation reaction catalyst KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2018-06-26 — — US disclosed
US-10005797-B2 Hydrosilylation reaction catalyst KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2018-06-26 — — US disclosed
US-20170233417-A1 HYDROSILYLATION REACTION CATALYST KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2017-08-17 — — US disclosed
US-20170233417-A1 HYDROSILYLATION REACTION CATALYST KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2017-08-17 — — US disclosed
WO-2016024607-A1 HYDROSILYLATION REACTION CATALYST 国立大学法人九州大学 2016-02-18 — — WO disclosed
US-7351339-B2 Using an auxiliary base to form a salt with the acid which is liquid at low enough temperature so that value product does not decompose during the removal of the liquid salt; e.g. acid catalyst removal; ionic liquids BASF AKTIENGESELLSCHAFT (DE) 2008-04-01 — — US disclosed
EP-1470136-B1 METHOD FOR THE SEPARATION OF ACIDS FROM CHEMICAL REACTION MIXTURES BY MEANS OF IONIC FLUIDS BASF AG (DE) 2007-03-28 — — EP disclosed
EP-1472201-A2 METHOD FOR THE SEPARATION OF ACIDS FROM CHEMICAL REACTION MIXTURES BY MEANS OF IONIC FLUIDS BASF AKTIENGESELLSCHAFT (DE) 2004-11-03 — — EP disclosed
EP-1470136-A1 METHOD FOR THE SEPARATION OF ACIDS FROM CHEMICAL REACTION MIXTURES BY MEANS OF IONIC FLUIDS BASF AKTIENGESELLSCHAFT (DE) 2004-10-27 — — EP disclosed
WO-2003062171-A2 METHOD FOR THE SEPARATION OF ACIDS FROM CHEMICAL REACTION MIXTURES BY MEANS OF IONIC FLUIDS BASF AKTIENGESELLSCHAFT (DE) 2003-07-31 — — WO disclosed
WO-2003062251-A1 METHOD FOR THE SEPARATION OF ACIDS FROM CHEMICAL REACTION MIXTURES BY MEANS OF IONIC FLUIDS BASF AKTIENGESELLSCHAFT (DE) 2003-07-31 — — WO disclosed
US-6297340-B1 WITHOUT ADDING ANY OXYGEN, AND TO REDUCE THE DANGER OF FIRE OREXPLOSION, REACTING AROMATIC VINYL COMPOUNDS OR ALLYL HALIDES WITH A SILICON COMPOUND HAVING HYDROSILYL GROUPS IN PRESENCE OF A CARBOXYLIC ACID, A SILYL ESTER OF A SULFONIC DOW CORNING ASIA, LTD. (JP) 2001-10-02 — — US disclosed
JP-H04283591-A SILYLOXY GROUP-CONTAINING COMPOUND AND PRODUCTION THEREOF ASAHI DENKA KOGYO KK 1992-10-08 — — JP 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-20170233417-A1 HYDROSILYLATION REACTION CATALYST IDH1, IDH3A, IDH2 TDP1 4460/4885ALDH1A1 2193/4885HPGD 954/4885
US-10005797-B2 Hydrosilylation reaction catalyst IDH1, IDH3A, IDH2 TDP1 4460/4885ALDH1A1 2193/4885HPGD 954/4885

“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.