SCHEMBL24788157

SCHEMBL24788157

COCCOCC(=O)NCCOCCOCC(=O)NCCCC[C@H](N)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OTC P00480 1/20 0.47
▸ GLP1R P43220 8/20 0.45
▸ DDAH1 O94760 2/20 0.44
▸ NOD1 Q9Y239 2/20 0.39
▸ TSHR P16473 2/20 0.38
▸ NOS3 P29474 2/20 0.38
▸ NOS1 P29475 2/20 0.38
▸ NOS2 P35228 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ GSR P00390 1/20 0.37

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
SCHEMBL1953200 0.97 OTC (0.49) OTCGLP1RDDAH1NOD1TSHR
SCHEMBL30409031 0.97 OTC (0.49) OTCGLP1RDDAH1NOD1TSHR
SCHEMBL1951953 0.96 OTC (0.50) OTCGLP1RDDAH1NOD1TSHR
SCHEMBL19019937 0.96 OTC (0.50) OTCGLP1RDDAH1NOD1TSHR
SCHEMBL24788082 0.95 GLP1R (0.45) OTCGLP1RDDAH1NOD1TSHR
SCHEMBL24788148 0.90 GLP1R (0.50) OTCGLP1RDDAH1NOD1TSHR
SCHEMBL24470266 0.90 GLP1R (0.48) OTCGLP1RDDAH1NOD1NOS1
SCHEMBL19801989 0.90 GLP1R (0.45) OTCGLP1RNOD1TSHRNOS3
SCHEMBL22844085 0.88 GSR (0.45) OTCGLP1RDDAH1NOD1GSR
SCHEMBL19135682 0.88 GLP1R (0.51) OTCGLP1RDDAH1NOD1CYP1A2

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-11530244-B2 Cyclic polypeptides for PCSK9 inhibition MERCK SHARP & DOHME LLC (US) 2022-12-20 — — 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-11530244-B2 Cyclic polypeptides for PCSK9 inhibition PCSK9, LDLR, PCSK7 OTC 3433/4885GLP1R 13/4885DDAH1 4150/4885

“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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