SCHEMBL17176996

SCHEMBL17176996

CC(C)(C)OC(=O)Oc1c(C(C)(C)C)cc(CCC(=O)OCCNC(=O)C(=O)NCCOC(=O)CCc2cc(C(C)(C)C)c(OC(=O)OC(C)(C)C)c(C(C)(C)C)c2)cc1C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ VCAM1 P19320 8/20 0.37
▸ TDP1 Q9NUW8 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ APP P05067 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
SCHEMBL17546545 0.90 GAA (0.38) GAAKMT2AVCAM1TDP1IDO1
SCHEMBL17171726 0.87 VCAM1 (0.38) GAAKMT2AVCAM1TDP1ALOX5
SCHEMBL17171727 0.86 VCAM1 (0.39) GAAKMT2AVCAM1TDP1ALOX5
SCHEMBL17546542 0.86 GAA (0.39) GAAKMT2AVCAM1TDP1ALOX5
SCHEMBL19103204 0.85 VCAM1 (0.36) GAAKMT2AVCAM1TDP1ALOX5
SCHEMBL19103203 0.84 VCAM1 (0.38) GAAKMT2AVCAM1TDP1ALOX5
SCHEMBL16790504 0.83 VCAM1 (0.38) GAAKMT2AVCAM1MEN1
SCHEMBL17171730 0.83 CYP4F2 (0.43) GAAKMT2AVCAM1
SCHEMBL17171725 0.83 VCAM1 (0.51) GAAKMT2AVCAM1MEN1
SCHEMBL17171708 0.82 DGKA (0.40) GAAKMT2AVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9777138-B2 Latent additive and composition containing latent additive ADEKA CORPORATION (JP) 2017-10-03 — — US disclosed
US-20170198117-A1 ANTIOXIDANT FOR THERMOPLASTIC RESIN AND THERMOPLASTIC RESIN COMPOSITION CONTAINING SAME ADEKA CORPORATION (JP) 2017-07-13 — — US disclosed
EP-3178905-A1 ANTIOXIDANT FOR THERMOPLASTIC RESIN AND THERMOPLASTIC RESIN COMPOSITION INCLUDING SAME Adeka Corporation (JP) 2017-06-14 — — EP disclosed
US-20150291772-A1 LATENT ADDITIVE AND COMPOSITION CONTAINING LATENT ADDITIVE ADEKA CORPORATION (JP) 2015-10-15 — — 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-20150291772-A1 LATENT ADDITIVE AND COMPOSITION CONTAINING LATENT ADDITIVE TCF7L2, LUC7L2, TLL2 GAA 2583/4885KMT2A 2013/4885VCAM1 4699/4885

“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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