SCHEMBL14195141

SCHEMBL14195141

CCC(C)(C)c1ccc(C(=O)NC(CO)C(=O)OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 12/20 0.49
▸ TAS1R1 Q7RTX1 12/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ GAA P10253 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ CA2 P00918 3/20 0.42
▸ CA1 P00915 2/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA9 Q16790 1/20 0.41

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
SCHEMBL13605108 0.87 TAS1R3 (0.49) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL5901366 0.83 NOS3 (0.49) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL29241144 0.82 TAS1R3 (0.50) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL29241142 0.82 TAS1R3 (0.50) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL13612957 0.81 L3MBTL1 (0.69) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL13885653 0.81 LNPEP (0.56) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL12983609 0.81 TAS1R3 (0.52) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL12983607 0.81 TAS1R3 (0.52) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL21663897 0.80 TAS1R3 (0.50) TAS1R3TAS1R1L3MBTL1GAARAB9A
SCHEMBL5995873 0.80 ALDH1A1 (0.51) TAS1R3TAS1R1L3MBTL1GAARAB9A

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-20080139597-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC, A DELAWARE LIMITED LIABILITY COMAPNY (BM) 2008-06-12 — — 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-20080139597-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS KIT, PRKCH, PRKCE TAS1R3 2202/4885TAS1R1 2142/4885L3MBTL1 4630/4885

“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.

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