SCHEMBL13889279

SCHEMBL13889279

CC(CCCCNC(=O)COCCOCCNC(=O)CCN1C(=O)C=CC1=O)C(=O)P=S

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.37
▸ POLB P06746 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MGLL Q99685 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PLK1 P53350 4/20 0.32
▸ EPOR P19235 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL13647116 0.89 HSD17B10 (0.36) POLBHSD17B10CYP3A4CYP2C19
SCHEMBL13686094 0.89 HSD17B10 (0.36) POLBHSD17B10CYP3A4CYP2C19
SCHEMBL13783671 0.89 GLP1R (0.40) GLP1RPOLBHSD17B10MGLLCYP3A4
SCHEMBL16507721 0.89 GLP1R (0.40) GLP1RPOLBHSD17B10MGLLCYP3A4
SCHEMBL16507765 0.89 GLP1R (0.35) GLP1RPOLBHSD17B10MGLLPLK1
SCHEMBL13889280 0.87 GLP1R (0.39) GLP1RPOLBHSD17B10MGLLCYP3A4
SCHEMBL10054214 0.85 GLP1R (0.37) GLP1RMGLLPLK1EPOR
SCHEMBL16507748 0.85 GLP1R (0.37) GLP1RMGLLPLK1EPOR
SCHEMBL14423081 0.84 PLK1 (0.37) GLP1RPLK1
SCHEMBL12409384 0.83 GLP1R (0.39) GLP1RPOLBHSD17B10MGLLCYP3A4

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-20090093408-A1 Protection of exendin-4 peptides through conjugation CONJUCHEM, LLC 2009-04-09 — — US disclosed
US-20090075890-A1 Long lasting synthetic exendin-4 peptide conjugates and methods of use thereof CONJUCHEM BIOTECHNOLOGIES INC. 2009-03-19 — — 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-20090075890-A1 Long lasting synthetic exendin-4 peptide conjugates and methods of use thereof IAPP, VIP, GLP1R GLP1R 3/4885POLB 4528/4885HSD17B10 4312/4885
US-20090093408-A1 Protection of exendin-4 peptides through conjugation VIP, PEPD, ANPEP GLP1R 32/4885POLB 4246/4885HSD17B10 4557/4885

“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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