SCHEMBL20993449

SCHEMBL20993449

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

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 8/20 0.54
NOD1 Q9Y239 7/20 0.40
FOLH1 Q04609 3/20 0.35
EPHX2 P34913 1/20 0.35
GLO1 Q04760 1/20 0.34

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
SCHEMBL20993450 1.00 GLP1R (0.54) GLP1RNOD1FOLH1EPHX2GLO1
SCHEMBL22024420 0.91 GLP1R (0.55) GLP1RNOD1FOLH1EPHX2GLO1
SCHEMBL24352155 0.89 GLP1R (0.53) GLP1RNOD1FOLH1EPHX2GLO1
SCHEMBL22585863 0.89 GLP1R (0.63) GLP1RNOD1FOLH1EPHX2GLO1
SCHEMBL22585862 0.88 GLP1R (0.62) GLP1RNOD1FOLH1GLO1
SCHEMBL22586437 0.88 GLP1R (0.62) GLP1RNOD1FOLH1GLO1
SCHEMBL25726353 0.88 GLP1R (0.59) GLP1RNOD1FOLH1GLO1
SCHEMBL21789855 0.87 GLP1R (0.52) GLP1RNOD1FOLH1EPHX2GLO1
SCHEMBL22585861 0.87 GLP1R (0.64) GLP1RNOD1FOLH1GLO1
SCHEMBL20750829 0.87 GLP1R (0.64) GLP1RNOD1FOLH1GLO1

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-20210300934-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2021-09-30 US disclosed
US-10961252-B2 Quinazoline and indole compounds to treat medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2021-03-30 US disclosed
US-20190135825-A1 Quinazoline and Indole Compounds to Treat Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2019-05-09 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 (3 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-10961252-B2 Quinazoline and indole compounds to treat medical disorders CFB, TFPI, MAOB GLP1R 3544/4885NOD1 808/4885FOLH1 2436/4885
US-20190135825-A1 Quinazoline and Indole Compounds to Treat Medical Disorders CFB, TFPI, MAOB GLP1R 3544/4885NOD1 808/4885FOLH1 2436/4885
US-20210300934-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH GLP1R 4432/4885NOD1 1289/4885FOLH1 1752/4885

“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.