SCHEMBL23005212

SCHEMBL23005212

C=CC[Si](OC(C#Cc1ccccc1)CCCCC)(C(C)C)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ MMP12 P39900 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ALDH1A1 P00352 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
SCHEMBL23005135 0.91 KMT2A (0.34) KMT2AMAPT
SCHEMBL23005253 0.86 KMT2A (0.34) KMT2AMEN1MAPTALDH1A1
SCHEMBL23005201 0.85 KMT2A (0.44) KMT2AMAPT
SCHEMBL23005219 0.84 KMT2A (0.36) KMT2AMAPT
SCHEMBL23005228 0.83 SIGMAR1 (0.39) KMT2AMEN1MAPT
SCHEMBL23005234 0.78 KMT2A (0.36) KMT2AMAPT
SCHEMBL23005167 0.77 — —
SCHEMBL23005220 0.71 — —
SCHEMBL23005258 0.70 HTR2A (0.41) MMP9KMT2AMEN1NPSR1MAPT
SCHEMBL6744835 0.67 MMP2 (0.49) MMP2MMP9MMP12KMT2AALDH1A1

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 MMP2 2914/4885MMP9 2637/4885MMP12 3192/4885
US-20210054003-A1 Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use HSD17B7, CYP4A22, PPOX MMP2 2914/4885MMP9 2637/4885MMP12 3192/4885

“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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