SCHEMBL21043285

SCHEMBL21043285

C=CCCCCCC(C)(CC(C)C)NC(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.32
LMNA P02545 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
SCHEMBL3116299 0.73 TSHR (0.35) TSHRALDH1A1LMNA
SCHEMBL17866189 0.72 TSHR (0.40) TSHRALDH1A1LMNA
Ammonia Solution, Strong SCHEMBL3116295 0.71 TSHR (0.41) TSHRALDH1A1
SCHEMBL13282214 0.71 ALDH1A1 (0.40) TSHRALDH1A1LMNA
SCHEMBL20049545 0.70 ALDH1A1 (0.39) TSHRALDH1A1LMNA
SCHEMBL12555775 0.70 ALDH1A1 (0.39) TSHRALDH1A1LMNA
SCHEMBL12555789 0.70 ALDH1A1 (0.39) TSHRALDH1A1LMNA
SCHEMBL3124527 0.69 TSHR (0.34) TSHRALDH1A1LMNA
SCHEMBL29764288 0.68
SCHEMBL891502 0.68 TSHR (0.48) TSHRALDH1A1LMNA

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-10301351-B2 Stitched polypeptides PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-05-28 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-10301351-B2 Stitched polypeptides VIP, IAPP, NGLY1 TSHR 2524/4885ALDH1A1 4098/4885LMNA 3761/4885

“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.