SCHEMBL20747625

SCHEMBL20747625

CC(C)C(C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccn1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 4/20 0.49
▸ DPP4 P27487 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ F2 P00734 3/20 0.42
▸ XIAP P98170 1/20 0.42
▸ MLX Q9UH92 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ PRSS1 P07477 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CMA1 P23946 1/20 0.40
▸ ACE P12821 2/20 0.40
▸ TACR1 P25103 1/20 0.40
▸ HSD11B1 P28845 1/20 0.39
▸ CTSG P08311 1/20 0.39

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
SCHEMBL18100584 1.00 ELANE (0.49) ELANEDPP4GAAF2XIAP
SCHEMBL20747589 1.00 ELANE (0.49) ELANEDPP4GAAF2XIAP
SCHEMBL30814203 0.91 ELANE (0.48) ELANEDPP4GAAF2XIAP
SCHEMBL16703831 0.91 ELANE (0.48) ELANEDPP4GAAF2XIAP
SCHEMBL30814176 0.91 ELANE (0.48) ELANEDPP4GAAF2XIAP
SCHEMBL20859027 0.91 ELANE (0.48) ELANEDPP4GAAF2XIAP
SCHEMBL20853469 0.91 ELANE (0.48) ELANEDPP4GAAF2XIAP
SCHEMBL16703830 0.91 ELANE (0.48) ELANEDPP4GAAF2XIAP
SCHEMBL16703327 0.91 ELANE (0.48) ELANEDPP4GAAF2XIAP
Hydrochloric Acid SCHEMBL18094983 0.90 ELANE (0.48) ELANEDPP4GAAF2XIAP

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-10207994-B2 NMDA antagonist prodrugs ASTRAZENECA AB (SE) 2019-02-19 — — 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 (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-10207994-B2 NMDA antagonist prodrugs GRIN1, GRIN2A, GRIN3A ELANE 2956/4885DPP4 1168/4885GAA 3289/4885

“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.

Send feedback