SCHEMBL810598

SCHEMBL810598

COC(=O)C(CC(C)C)NC(=O)c1cc(C(=O)NC(CC(C)C)C(=O)OC)cc(C(=O)NC(CC(C)C)C(=O)OC)c1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 19/20 0.82
TAS1R1 Q7RTX1 19/20 0.82
GRN P28799 1/20 0.56
SORT1 Q99523 1/20 0.56

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
SCHEMBL4195341 0.91 TAS1R3 (1.00) TAS1R3TAS1R1GRNSORT1
SCHEMBL4195344 0.91 TAS1R3 (1.00) TAS1R3TAS1R1GRNSORT1
SCHEMBL18784081 0.89 TAS1R3 (0.72) TAS1R3TAS1R1GRNSORT1
SCHEMBL810660 0.87 TAS1R3 (0.68) TAS1R3TAS1R1GRNSORT1
SCHEMBL4205980 0.87 TAS1R3 (1.00) TAS1R3TAS1R1
SCHEMBL700554 0.87 TAS1R3 (0.68) TAS1R3TAS1R1GRNSORT1
SCHEMBL4205978 0.87 TAS1R3 (1.00) TAS1R3TAS1R1
SCHEMBL700555 0.87 TAS1R3 (0.68) TAS1R3TAS1R1GRNSORT1
SCHEMBL6241209 0.85 TAS1R3 (0.68) TAS1R3TAS1R1
SCHEMBL10407750 0.85 TAS1R3 (0.68) TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902281-B2 Thermoplastic resin composition and molded article thereof MITSUI CHEMICALS, INC. (JP) 2011-03-08 US disclosed
US-20090186992-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE THEREOF MITSUI CHEMICALS, INC (JP) 2009-07-23 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-20090186992-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE THEREOF TRIM59, TRIM4, MAP1LC3C TAS1R3 1722/4885TAS1R1 1732/4885GRN 1559/4885

“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.