SCHEMBL12701406

SCHEMBL12701406

CCOC(=O)C1CCN(B(C)O)CC1C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.38
▸ ALDH1A1 P00352 7/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33

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
SCHEMBL10137516 0.88 MAPT (0.34) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL21865920 0.80 MAPT (0.41) MAPTALDH1A1KMT2A
SCHEMBL21865774 0.80 MAPT (0.41) MAPTALDH1A1KMT2A
SCHEMBL14376312 0.78 MAPT (0.54) MAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL14065598 0.78 MAPT (0.54) MAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL14065593 0.78 MAPT (0.54) MAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL426312 0.78 MAPT (0.57) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13130106 0.76 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2TSHRKDM4E
SCHEMBL13473844 0.75 SLC6A3 (0.53) MAPT
SCHEMBL12592383 0.75 SLC6A3 (0.53) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110092704-A1 Preparation of triazospiro compounds EURO-CELTIQUE S.A. (LU) 2011-04-21 — — 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-20110092704-A1 Preparation of triazospiro compounds CBR1, TBXA2R, CBR3 MAPT 3552/4885ALDH1A1 495/4885SMN1; SMN2 3706/4885

“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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