Sugi Predict

Sugi Predict / Compounds / SCHEMBL5146345

SCHEMBL5146345

SCHEMBL5146345

C=Cc1ccc([Si](OC)(OC)c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ TRPA1 O75762 2/20 0.34
▸ HDAC8 Q9BY41 1/20 0.33
▸ TDP1 Q9NUW8 2/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ DAPK3 O43293 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ NTRK1 P04629 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ CSF1R P07333 1/20 0.31
▸ RET P07949 1/20 0.31
▸ MET P08581 1/20 0.31
▸ PDGFRB P09619 1/20 0.31
▸ FGFR1 P11362 1/20 0.31
▸ FLT3 P36888 1/20 0.31

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
SCHEMBL5014438 0.92 ALDH1A1 (0.50) ALDH1A1TSHRTRPA1HDAC8TDP1
SCHEMBL20872887 0.91 ALDH1A1 (0.43) ALDH1A1TSHRTRPA1TP53POLB
SCHEMBL706592 0.83 ESR1 (0.41) ALDH1A1TSHRTRPA1ESR1ESR2
SCHEMBL29895692 0.83 NQO2 (0.41) ALDH1A1TSHRTRPA1TDP1TP53
SCHEMBL20872939 0.83 NQO2 (0.41) ALDH1A1TSHRTRPA1TDP1TP53
SCHEMBL49008 0.81 CA4 (0.41) ALDH1A1TSHRTRPA1ESR1ESR2
SCHEMBL27596877 0.81 CA4 (0.41) ALDH1A1TSHRTRPA1ESR1ESR2
SCHEMBL2498900 0.80 ALDH1A1 (0.43) ALDH1A1TSHRHDAC8
SCHEMBL20873026 0.80 ALDH1A1 (0.38) ALDH1A1TSHRTDP1CYP1A2CYP1B1
SCHEMBL29895552 0.80 ALDH1A1 (0.38) ALDH1A1TSHRTDP1CYP1A2CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10899891-B2 Reactive polysiloxane and polymerizable composition comprising same NISSAN CHEMICAL CORPORATION (JP) 2021-01-26 — — US disclosed
US-10894800-B2 Polymerizable silane compound NISSAN CHEMICAL CORPORATION (JP) 2021-01-19 — — US disclosed
US-10894800-B2 Polymerizable silane compound NISSAN CHEMICAL CORPORATION (JP) 2021-01-19 — — US disclosed
EP-3466956-B1 POLYMERIZABLE SILANE COMPOUND NISSAN CHEMICAL CORP (JP) 2020-12-09 — — EP disclosed
EP-3466994-B1 REACTIVE POLYSILOXANE AND POLYMERIZABLE COMPOSITION CONTAINING SAME NISSAN CHEMICAL CORP (JP) 2020-09-16 — — EP disclosed
US-20190256533-A1 POLYMERIZABLE SILANE COMPOUND NISSAN CHEMICAL CORPORATION (JP) 2019-08-22 — — US disclosed
US-20190256664-A1 REACTIVE POLYSILOXANE AND POLYMERIZABLE COMPOSITION COMPRISING SAME NISSAN CHEMICAL CORPORATION (JP) 2019-08-22 — — US disclosed
US-20190256533-A1 POLYMERIZABLE SILANE COMPOUND NISSAN CHEMICAL CORPORATION (JP) 2019-08-22 — — US disclosed
EP-3466994-A1 REACTIVE POLYSILOXANE AND POLYMERIZABLE COMPOSITION CONTAINING SAME Nissan Chemical Corporation (JP) 2019-04-10 — — EP disclosed
EP-3466956-A1 POLYMERIZABLE SILANE COMPOUND Nissan Chemical Corporation (JP) 2019-04-10 — — EP disclosed
EP-0823450-B1 COMPOSITE AND MOLDINGS PRODUCED THEREFROM MITSUBISHI RAYON CO (JP) 2004-11-24 — — EP disclosed
US-6727337-B2 STORAGE STABLE, ULTRAVIOLET RADIATION CURABLE, TRANSPARENT POLYSILOXANE OR POLYSILSESQUIOXANE COMPRISING SILANEDIOL OR SILANETRIOL MONOMER WITH STYRENE GROUP THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2004-04-27 — — US disclosed
WO-2003104304-A1 METHOD FOR MAKING SILOXANE POLYMERS THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2003-12-18 — — WO disclosed
US-20030232951-A1 Preparation of low loss optical material from difunctional silyl enol ethers and difunctional silanols AUSTRALIAN NATIONAL UNIVERSITY, THE (AU) 2003-12-18 — — US disclosed
WO-2003097719-A1 IMPROVEMENT OF LOW LOSS OPTICAL MATERIAL THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2003-11-27 — — WO disclosed
US-20030216537-A1 LOW LOSS OPTICAL MATERIAL AUSTRALIAN NATIONAL UNIVERSITY, THE (AU) 2003-11-20 — — US disclosed
EP-0696621-B1 COATING COMPOSITION AND SURFACE-COATED MOLDING PRODUCED THEREWITH MITSUBISHI RAYON CO (JP) 2000-10-11 — — EP disclosed
EP-0823450-A1 COMPOSITE AND MOLDINGS PRODUCED THEREFROM MITSUBISHI RAYON CO., LTD. (JP) 1998-02-11 — — EP disclosed
US-5695851-A CROSSLINKABLE, POLYMERIZABLE COMPOSITION CONTAINING (METH)ACRYLOYLOXY GROUPS, SILICA WHOSE SURFACE HAS BEEN MODIFIED WITH AN ORGANOSILANE-CONTAINING COMPOUND, AND A HIGH ENERGY RADIATION POLYMERIZATION INITIATOR MITSUBISHI RAYON CO., LTD. (JP) 1997-12-09 — — US disclosed
EP-0696621-A1 COATING COMPOSITION AND SURFACE-COATED MOLDING PRODUCED THEREWITH MITSUBISHI RAYON CO., LTD. (JP) 1996-02-14 — — 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 (3 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-20190256533-A1 POLYMERIZABLE SILANE COMPOUND PCNA, ARL1, CCNE1 ALDH1A1 958/4885TSHR 4498/4885TRPA1 1030/4885
US-10894800-B2 Polymerizable silane compound PCNA, ARL1, CCNE1 ALDH1A1 958/4885TSHR 4498/4885TRPA1 1030/4885
US-20030232951-A1 Preparation of low loss optical material from difunctional silyl enol ethers and difunctional silanols CNKSR1, CCNL2, SAAL1 ALDH1A1 461/4885TSHR 3837/4885TRPA1 1817/4885

“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.