SCHEMBL13991900

SCHEMBL13991900

COC(=O)CNC(=O)OCCCOC(=O)NC(CC(C)C)C(=O)OCCCCCCOC(=O)C(CC(C)C)NC(=O)OCCCOC(C)=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 12/20 0.35
TYR P14679 1/20 0.34
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
FOLH1 Q04609 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32

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
SCHEMBL14958646 0.87 FOLH1 (0.42) FOLH1TAS1R3TAS1R1
SCHEMBL15180217 0.83 EPHX1 (0.37) ACHETYRCTSLCTSBCTSS
SCHEMBL30174611 0.70 BIRC2 (0.54) ACHEFOLH1TAS1R3TAS1R1
SCHEMBL14373742 0.69 ALDH1A1 (0.50) ACHE
SCHEMBL11675839 0.69 ALDH1A1 (0.50) ACHE
SCHEMBL27864476 0.69 ALDH1A1 (0.50) ACHE
SCHEMBL11675841 0.69 ALDH1A1 (0.50) ACHE
SCHEMBL13960047 0.69 ALDH1A1 (0.50) FOLH1TAS1R3TAS1R1
SCHEMBL7279383 0.68 FOLH1 (0.47) FOLH1TAS1R3TAS1R1
SCHEMBL7279380 0.68 FOLH1 (0.47) FOLH1TAS1R3TAS1R1

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-20080299174-A1 Bis-(Alpha-Amino)-Diol-Diester-Containing Poly (Ester Amide) and Poly (Ester Urethane) Compositions and Methods of Use MEDIVAS, LLC 2008-12-04 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-20080299174-A1 Bis-(Alpha-Amino)-Diol-Diester-Containing Poly (Ester Amide) and Poly (Ester Urethane) Compositions and Methods of Use APEH, DAO, DNPEP ACHE 489/4885TYR 1611/4885CTSL 830/4885

“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.