SCHEMBL4644770

SCHEMBL4644770

COC(c1ccc(C(OC)C2CCC3OC3C2)cc1)C1CCC2OC2C1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.44
EPHX1 P07099 2/20 0.38
SLC6A2 P23975 1/20 0.37
IDO1 P14902 2/20 0.34
FPR2 P25090 3/20 0.34
PROKR1 Q8TCW9 3/20 0.34
SLC6A3 Q01959 3/20 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
SCHEMBL16262381 0.95 EPHX1 (0.41) SLC6A4EPHX1SLC6A2IDO1FPR2
Methyl Alcohol SCHEMBL8743765 0.80 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3
SCHEMBL14672805 0.79 SLC6A2 (0.41) SLC6A4EPHX1SLC6A2IDO1SLC6A3
SCHEMBL16979030 0.73 SLC6A4 (0.49) SLC6A4SLC6A2IDO1FPR2PROKR1
SCHEMBL24369276 0.72 PPM1B (0.31)
SCHEMBL4598274 0.72 SLC6A4 (0.47) SLC6A4SLC6A2IDO1FPR2PROKR1
SCHEMBL11248115 0.72 SLC6A4 (0.47) SLC6A4SLC6A2IDO1FPR2PROKR1
SCHEMBL744402 0.72 SLC6A4 (0.47) SLC6A4EPHX1SLC6A2IDO1FPR2
SCHEMBL1134153 0.71
SCHEMBL19144912 0.71 IDO1 (0.64) SLC6A4EPHX1SLC6A2IDO1FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4091578-B1 METHOD FOR PRODUCING PLATE DENTURE TOKUYAMA DENTAL CORP (JP) 2024-10-09 EP disclosed
US-11857385-B2 Method of producing plate denture, curable composition for stereolithography, and plate denture production kit TOKUYAMA DENTAL CORPORATION (JP) 2024-01-02 US disclosed
US-20230320940-A1 PHOTOCATIONICALLY CURABLE COMPOSITION AND DENTAL CURABLE COMPOSITION TOKUYAMA DENTAL CORPORATION (JP) 2023-10-12 US disclosed
EP-4194477-A1 PHOTOCATIONIC CURABLE COMPOSITION AND CURABLE DENTAL COMPOSITION Tokuyama Dental Corporation (JP) 2023-06-14 EP disclosed
US-20230137898-A1 METHOD OF PRODUCING PLATE DENTURE, CURABLE COMPOSITION FOR STEREOLITHOGRAPHY, AND PLATE DENTURE PRODUCTION KIT TOKUYAMA DENTAL CORPORATION (JP) 2023-05-04 US disclosed
EP-4091578-A1 METHOD FOR PRODUCING PLATE DENTURE, CURABLE STEREOLITHOGRAPHIC COMPOSITION, AND PLATE DENTURE PRODUCTION KIT Tokuyama Dental Corporation (JP) 2022-11-23 EP disclosed
US-8900775-B2 Hologram recording material and hologram recording medium TDK CORPORATION (JP) 2014-12-02 US disclosed
US-20130034805-A1 HOLOGRAM RECORDING MATERIAL AND HOLOGRAM RECORDING MEDIUM TDK CORPORATION (JP) 2013-02-07 US disclosed
EP-1591098-B1 Cationically curable composition for dental use TOKUYAMA CORP (JP) 2008-08-13 EP disclosed
US-7365106-B2 Cationically curable composition for dental use TOKUYAMA CORPORATION (JP) 2008-04-29 US disclosed
US-20050250868-A1 Cationically curable composition for dental use TOKUYAMA CORPORATION (JP) 2005-11-10 US disclosed
EP-1591098-A1 Cationically curable composition for dental use TOKUYAMA CORPORATION (JP) 2005-11-02 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 (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-20230320940-A1 PHOTOCATIONICALLY CURABLE COMPOSITION AND DENTAL CURABLE COMPOSITION CTH, GCLC, AAAS SLC6A4 2943/4885EPHX1 1529/4885SLC6A2 3983/4885

“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.