SCHEMBL17049853

SCHEMBL17049853

CC(C)C(C(=O)O)C(C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
SLC7A5 Q01650 2/20 0.41
FPR1 P21462 1/20 0.32
FPR2 P25090 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
GABRR1 P24046 2/20 0.31
RNPEP Q9H4A4 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 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
SCHEMBL8605204 0.87 TP53 (0.47) TP53SLC7A5GABRR1RNPEPCYP1A2
SCHEMBL25867914 0.85 TP53 (0.40) TP53SLC7A5SLC1A3SLC1A2SLC1A1
Diethylamine SCHEMBL27873528 0.83 TP53 (0.35) TP53SLC7A5FPR1FPR2
SCHEMBL16438180 0.83 TP53 (0.50) TP53SLC7A5FPR1FPR2SLC1A3
SCHEMBL66413 0.83 TP53 (0.50) TP53SLC7A5FPR1FPR2SLC1A3
SCHEMBL659817 0.83 TP53 (0.50) TP53SLC7A5FPR1FPR2SLC1A3
SCHEMBL24287053 0.82 TP53 (0.38) TP53SLC7A5SLC1A3SLC1A2SLC1A1
SCHEMBL14792993 0.80 TP53 (0.36) TP53SLC7A5FPR1FPR2
Water SCHEMBL8870694 0.80 TP53 (0.47) TP53SLC7A5FPR1FPR2SLC1A3
SCHEMBL2538284 0.79 TP53 (0.40) TP53SLC7A5

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-20240239828-A1 MANNOSE 6-PHOSPHATE OR ASGPR RECEPTOR BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2024-07-18 US disclosed
EP-4194428-A1 HYDROCOLLOID PARTICLE SUSPENSION USEFUL AS RHEOLOGICAL MODIFIER FOR CEMENTITIOUS APPLICATIONS, USE OF A HYDROCOLLOID PARTICLE SUSPENSION Construction Research & Technology GmbH (DE) 2023-06-14 EP disclosed
US-9120900-B2 Polymer-bound bisacylphosphine oxides BASF SE (DE) 2015-09-01 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-20240239828-A1 MANNOSE 6-PHOSPHATE OR ASGPR RECEPTOR BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS M6PR, ASGR1, IGF2R TP53 3465/4885SLC7A5 1587/4885FPR1 1026/4885

“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.