SCHEMBL19801989

SCHEMBL19801989

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

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.45
▸ OTC P00480 1/20 0.44
▸ NOS2 P35228 5/20 0.40
▸ NOS1 P29475 4/20 0.40
▸ NOS3 P29474 3/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ NOD1 Q9Y239 1/20 0.39
▸ FOLH1 Q04609 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL24788157 0.90 OTC (0.47) GLP1ROTCNOS2NOS1NOS3
SCHEMBL24470266 0.90 GLP1R (0.48) GLP1ROTCNOS1NOD1MEN1
SCHEMBL13640939 0.90 GLP1R (0.41) GLP1RFOLH1MEN1KMT2A
SCHEMBL24788148 0.90 GLP1R (0.50) GLP1ROTCNOS2NOS1NOS3
SCHEMBL24788082 0.90 GLP1R (0.45) GLP1ROTCNOS2NOS1NOS3
SCHEMBL22844085 0.88 GSR (0.45) GLP1ROTCNOD1
SCHEMBL19135682 0.88 GLP1R (0.51) GLP1ROTCCYP1A2NOD1
SCHEMBL19803897 0.88 OTC (0.45) GLP1ROTCNOS2NOS1NOS3
SCHEMBL1953200 0.87 OTC (0.49) GLP1ROTCNOS2NOS1NOS3
SCHEMBL30409031 0.87 OTC (0.49) GLP1ROTCNOS2NOS1NOS3

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 2 patents. 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
US-20180021402-A1 MODULATORS OF COMPLEMENT ACTIVITY UCB HOLDINGS, INC. 2018-01-25 — — 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 (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-20180021402-A1 MODULATORS OF COMPLEMENT ACTIVITY C3AR1, C1QBP, C5AR1 GLP1R 575/4885OTC 2219/4885NOS2 4015/4885
US-11530244-B2 Cyclic polypeptides for PCSK9 inhibition PCSK9, LDLR, PCSK7 GLP1R 13/4885OTC 3433/4885NOS2 4545/4885

“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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