SCHEMBL25928833

SCHEMBL25928833

CC(C)C(=O)OCCCOC(=O)[C@@H](C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ HCAR2 Q8TDS4 2/20 0.31
▸ ATM Q13315 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ NAAA Q02083 1/20 0.30
▸ ALOX15 P16050 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
SCHEMBL25932466 0.91 ALOX15 (0.32) ALDH1A1ALOX15
SCHEMBL9480850 0.88 ALDH1A1 (0.40) ALDH1A1ATMNAAA
SCHEMBL17212387 0.83 SMN1; SMN2 (0.35) ALDH1A1HCAR2
SCHEMBL7224938 0.82 ALDH1A1 (0.54) ALDH1A1HCAR2ATMNAAA
SCHEMBL17403977 0.82 ALDH1A1 (0.54) ALDH1A1HCAR2ATMNAAA
SCHEMBL25928819 0.81 ALOX15 (0.32) ALOX15
SCHEMBL27982814 0.80 NAAA (0.44) ALDH1A1HCAR2NAAA
SCHEMBL8421539 0.80 NAAA (0.44) ALDH1A1HCAR2NAAA
SCHEMBL7224840 0.80 NAAA (0.52) ALDH1A1HCAR2ATMNAAA
SCHEMBL20747281 0.80 CYP1A2 (0.38) ALDH1A1

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-11702404-B2 GLP-1R modulating compounds GILEAD SCIENCES, INC. (US) 2023-07-18 — — 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-11702404-B2 GLP-1R modulating compounds GLP1R, GIPR, GPR119 ALDH1A1 3556/4885HCAR2 483/4885ATM 4056/4885

“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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