SCHEMBL23005133

SCHEMBL23005133

C=CC[Si](OCC#Cc1ccc(OC)cc1)(C(C)C)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ APP P05067 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ GRM5 P41594 1/20 0.36
▸ ACACB O00763 4/20 0.34
▸ EGLN1 Q9GZT9 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ MMP2 P08253 1/20 0.32
▸ MMP3 P08254 1/20 0.32

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
SCHEMBL23005216 0.85 EGLN1 (0.32) CYP3A4EGLN1CYP1A2CYP2D6CYP2C19
SCHEMBL23005258 0.85 HTR2A (0.41) CHRM2CHRM1ALDH1A1CYP3A4CYP1A2
SCHEMBL23005173 0.82 SLC6A4 (0.32) EGLN1AOC3MAOB
SCHEMBL23005269 0.82 PTPN11 (0.39) ALDH1A1KDM4ETSHRSMN1; SMN2CYP1A2
SCHEMBL20702293 0.73 APP (0.43) CHRM2CHRM1APPALDH1A1CYP3A4
SCHEMBL23005255 0.72 — —
SCHEMBL23005163 0.70 — —
SCHEMBL9834499 0.69 APP (0.53) CHRM2CHRM1APPALDH1A1KDM4E
SCHEMBL23005168 0.69 — —
SCHEMBL23005264 0.69 — —

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
US-11174275-B2 Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use DREXEL UNIVERSITY (US) 2021-11-16 — — US disclosed
US-20210054003-A1 Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use DREXEL UNIVERSITY 2021-02-25 — — 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 (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-11174275-B2 Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use HSD17B7, CYP4A22, PPOX CHRM2 3363/4885CHRM1 2820/4885APP 3235/4885
US-20210054003-A1 Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use HSD17B7, CYP4A22, PPOX CHRM2 3363/4885CHRM1 2820/4885APP 3235/4885

“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.

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