SCHEMBL2362771

SCHEMBL2362771

C=CCC1(CC=C)C[C@@H](C(=O)O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
CAD P27708 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL2362773 1.00 HTT (0.39) HTTCADALDH1A1
SCHEMBL1449554 0.79 KMT2A (0.36) HTTALDH1A1
SCHEMBL7455295 0.77 HTT (0.46) HTTCADALDH1A1
SCHEMBL7280583 0.75 CREBBP (0.32) ALDH1A1
SCHEMBL17048706 0.75 CREBBP (0.32) ALDH1A1
SCHEMBL8880745 0.75 CREBBP (0.32) ALDH1A1
SCHEMBL25414095 0.67 HTT (0.46) HTTCAD
SCHEMBL1973599 0.67 HTT (0.55) HTTCAD
SCHEMBL7551520 0.67 HTT (0.46) HTTCAD
SCHEMBL19585894 0.67 HTT (0.46) HTTCAD

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394970-B2 Process for manufacturing a glutamic acid derivative and a pyroglutamic acid derivative and a novel intermediate in the manufacture thereof AJINOMOTO CO., INC. (JP) 2013-03-12 US disclosed
EP-1582514-B1 PROCESSES FOR PRODUCING GLUTAMIC ACID DERIVATIVE, A PYROGLUTAMIC ACID DERIVATIVE AND A NOVEL INTERMEDIATE FOR PRODUCTION AJINOMOTO KK (JP) 2011-08-31 EP disclosed
US-7674915-B2 Process for manufacturing a glutamic acid derivative and a pyroglutamic acid derivative and a novel intermediate in the manufacture thereof AJINOMOTO CO., INC. (JP) 2010-03-09 US disclosed
US-20100010234-A1 PROCESS FOR MANUFACTURING A GLUTAMIC ACID DERIVATIVE AND A PYROGLUTAMIC ACID DERIVATIVE AND A NOVEL INTERMEDIATE IN THE MANUFACTURE THEREOF AJINOMOTO CO. INC (JP) 2010-01-14 US disclosed
US-20060009394-A1 Process for manufacturing a glutamic acid derivative and a pyroglutamic acid derivative and a novel intermediate in the manufacture thereof AJINOMOTO CO. INC (JP) 2006-01-12 US disclosed
EP-1582514-A1 PROCESSES FOR PRODUCING GLUTAMIC ACID DERIVATIVE AND PYROGLUTAMIC ACID DERIVATIVE AND NOVEL INTERMEDIATE FOR PRODUCTION Ajinomoto Co., Inc. (JP) 2005-10-05 EP 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-20100010234-A1 PROCESS FOR MANUFACTURING A GLUTAMIC ACID DERIVATIVE AND A PYROGLUTAMIC ACID DERIVATIVE AND A NOVEL INTERMEDIATE IN THE MANUFACTURE THEREOF PTMA, GRIK5, GLUL HTT 861/4885CAD 2574/4885ALDH1A1 1297/4885
US-20060009394-A1 Process for manufacturing a glutamic acid derivative and a pyroglutamic acid derivative and a novel intermediate in the manufacture thereof PTMA, GRIK5, GLUL HTT 861/4885CAD 2574/4885ALDH1A1 1297/4885

“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.