SCHEMBL21291808

SCHEMBL21291808

CC=CC(=O)OCCCCCCCCCCC[SiH2]C(OC)OC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.41
ATM Q13315 1/20 0.40
TSHR P16473 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 1/20 0.37
APP P05067 6/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HPGD P15428 1/20 0.31
HTT P42858 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL341121 0.94 ATM (0.42) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL28074015 0.92 ATM (0.41) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL8461574 0.87 ATM (0.36) HCAR2ATM
SCHEMBL2714285 0.84 ATM (0.42) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL29402140 0.83 TSHR (0.59) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL26093523 0.83 HCAR2 (0.41) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL26095434 0.83 HCAR2 (0.41) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL21101830 0.83 TSHR (0.59) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL26094923 0.83 HCAR2 (0.41) HCAR2ATMTSHRALDH1A1CYP3A4
SCHEMBL22574893 0.83 HCAR2 (0.41) HCAR2ATMTSHRALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3730121-B1 DENTAL ADHESIVE MATERIAL KIT KURARAY NORITAKE DENTAL INC (JP) 2023-10-25 EP disclosed
WO-2023136337-A1 DENTAL COMPOSITION, METHOD FOR MANUFACTURING SAME, AND DENTAL SURFACE-TREATED FILLER クラレノリタケデンタル株式会社 2023-07-20 WO disclosed
WO-2023106419-A1 DENTAL CURABLE COMPOSITION クラレノリタケデンタル株式会社 2023-06-15 WO disclosed
US-11173100-B2 Multi-part dental cement KURARAY NORITAKE DENTAL INC. (JP) 2021-11-16 US disclosed
EP-3530257-B1 SELF-ADHESIVE DENTAL COMPOSITE RESIN KURARAY NORITAKE DENTAL INC (JP) 2021-09-08 EP disclosed
EP-3530258-B1 MULTI-PACK TYPE DENTAL CEMENT KURARAY NORITAKE DENTAL INC (JP) 2021-08-18 EP disclosed
US-10987281-B2 Self-adhesive dental composite resin KURARAY NORITAKE DENTAL INC. (JP) 2021-04-27 US disclosed
US-20210015716-A1 DENTAL ADHESIVE MATERIAL KIT KURARAY NORITAKE DENTAL INC. (JP) 2021-01-21 US disclosed
EP-3730121-A1 DENTAL ADHESIVE MATERIAL KIT Kuraray Noritake Dental Inc. (JP) 2020-10-28 EP disclosed
US-20200179237-A1 SELF-ADHESIVE DENTAL COMPOSITE RESIN KURARAY NORITAKE DENTAL INC. (JP) 2020-06-11 US disclosed
US-20190262240-A1 MULTI-PART DENTAL CEMENT KURARAY NORITAKE DENTAL INC. (JP) 2019-08-29 US disclosed
EP-3530257-A1 SELF-ADHESIVE DENTAL COMPOSITE RESIN Kuraray Noritake Dental Inc. (JP) 2019-08-28 EP disclosed
EP-3530258-A1 MULTI-PACK TYPE DENTAL CEMENT Kuraray Noritake Dental Inc. (JP) 2019-08-28 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 (4 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-20190262240-A1 MULTI-PART DENTAL CEMENT ASH2L, CAD, SETDB1 HCAR2 856/4885ATM 696/4885TSHR 4621/4885
US-11173100-B2 Multi-part dental cement ASH2L, CAD, SETDB1 HCAR2 856/4885ATM 696/4885TSHR 4621/4885
US-10987281-B2 Self-adhesive dental composite resin SMCHD1, CDH1, SMC1A HCAR2 743/4885ATM 1327/4885TSHR 1946/4885
US-20200179237-A1 SELF-ADHESIVE DENTAL COMPOSITE RESIN SMCHD1, CDH1, SMC1A HCAR2 743/4885ATM 1327/4885TSHR 1946/4885

“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.