SCHEMBL19660102

SCHEMBL19660102

CC/C=C1\C=C(CC)C(=O)O1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL11081691 1.00 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1
SCHEMBL138960 0.72
SCHEMBL22654555 0.72
SCHEMBL16574233 0.68
SCHEMBL4408799 0.67 ACHE (0.35)
SCHEMBL4408803 0.67 ACHE (0.35)
SCHEMBL14613199 0.64
SCHEMBL18196033 0.64
SCHEMBL10412248 0.63
SCHEMBL11509922 0.63 TSHR (0.48) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10844033-B2 Method for preparing delta-lactones Qatar Found. For Ed., Science and Community Development (QA) 2020-11-24 US disclosed
US-20190127343-A1 METHOD FOR PREPARING DELTA-LACTONES HAMAD BIN KHALIFA UNIVERSITY (QA) 2019-05-02 US disclosed
WO-2017202644-A1 METHOD FOR PREPARING DELTA-LACTONES QATAR FOUNDATION FOR EDUCATION, SCIENCE AND COMMUNITY DEVELOPMENT (QA) 2017-11-30 WO 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-10844033-B2 Method for preparing delta-lactones DLK1, LBR, DHPS ALDH1A1 1909/4885TSHR 730/4885MAPK1 4383/4885
US-20190127343-A1 METHOD FOR PREPARING DELTA-LACTONES DLK1, LBR, DHPS ALDH1A1 1909/4885TSHR 730/4885MAPK1 4383/4885

“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.