SCHEMBL23923274

SCHEMBL23923274

OC1CCCC2CC3CC4CC5CC6CC7CC8CCCCC8CC7CC6CC5CC4CC3CC12

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD11B1 P28845 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
SCHEMBL29161134 1.00 SLC18A3 (0.33) SLC18A3CA1CA2CA4HSD17B10
SCHEMBL26708757 0.81 MAPT (0.37) SLC18A3CA1CA2CA4HSD17B10
SCHEMBL4613757 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1
SCHEMBL21757863 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1
SCHEMBL7733797 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1
SCHEMBL8161261 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1
SCHEMBL13767450 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1
SCHEMBL3038819 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1
SCHEMBL712232 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1
SCHEMBL838630 0.74 CA1 (0.46) SLC18A3CA1CA2CA4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113736056-B Compositions, methods of making the same, and materials made therefrom 财团法人工业技术研究院 2023-02-28 CN disclosed
US-20210323985-A1 SHIELDING AGENTS AND THEIR USE ENDOCYTE INC (US) 2021-10-21 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 (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-20210323985-A1 SHIELDING AGENTS AND THEIR USE PSMA6, PSMA2, PSMA1 SLC18A3 1539/4885CA1 180/4885CA2 2183/4885

“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.