SCHEMBL19602453

SCHEMBL19602453

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)OCC1COC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 4/20 0.46
▸ CTSS P25774 3/20 0.46
▸ CTSL P07711 2/20 0.45
▸ CTSB P07858 1/20 0.45
▸ PREP P48147 1/20 0.43
▸ CA2 P00918 2/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CYP2D6 P10635 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ TRPA1 O75762 2/20 0.38
▸ PSENEN Q9NZ42 1/20 0.37
▸ ELANE P08246 1/20 0.37
▸ KLK5 Q9Y337 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ATM Q13315 1/20 0.37

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
SCHEMBL30345605 0.87 CTSK (0.44) CTSKCTSSCTSLCTSBPREP
SCHEMBL24049431 0.80 PSMB5 (0.53) CTSKCTSSCTSLCTSBCA2
SCHEMBL16770022 0.79 CTSK (0.42) CTSKCTSSCTSLCTSBPREP
SCHEMBL16768022 0.78 CTSK (0.42) CTSKCTSSCTSLCTSBPREP
SCHEMBL3727156 0.77 CTSK (0.52) CTSKCTSSCTSLCTSBPREP
SCHEMBL32662439 0.76 KMT2A (0.44) CTSKCTSSCA2CA1CA7
SCHEMBL28469457 0.76 CTSK (0.55) CTSKCTSSCTSLCTSBPREP
SCHEMBL2721327 0.76 CTSK (0.55) CTSKCTSSCTSLCTSBPREP
SCHEMBL13956771 0.76 CTSK (0.55) CTSKCTSSCTSLCTSBPREP
SCHEMBL23260554 0.76 CTSK (0.57) CTSKCTSSCTSLCTSBPREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230132298-A1 OXABOROLE ESTERS AND USES THEREOF ANACOR PHARMACEUTICALS, LLC 2023-04-27 — — US disclosed
EP-3578562-B1 L-VALINATE AMIDE BENZOXABOROLE DERIVATIVES FOR THE TREATMENT OF PARASITIC DISEASES ANACOR PHARMACEUTICALS INC (US) 2021-06-23 — — EP disclosed
US-10882872-B2 Oxaborole esters and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2021-01-05 — — US disclosed
US-10562921-B2 Oxaborole esters and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2020-02-18 — — US disclosed
EP-3578562-A1 L-VALINATE AMIDE BENZOXABOROLE DERIVATIVES FOR THE TREATMENT OF PARASITIC DISEASES Anacor Pharmaceuticals, Inc (US) 2019-12-11 — — EP disclosed
WO-2017195069-A1 OXABOROLE ESTERS AND USES THEREOF ANACOR PHARMACEUTICALS, INC. (US) 2017-11-16 — — WO disclosed
US-20170327519-A1 OXABOROLE ESTERS AND USES THEREOF ANACOR PHARMACEUTICALS, INC. (US) 2017-11-16 — — 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 (4 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-20230132298-A1 OXABOROLE ESTERS AND USES THEREOF OXA1L, HSD17B12, OXER1 CTSK 3925/4885CTSS 3911/4885CTSL 2271/4885
US-10882872-B2 Oxaborole esters and uses thereof OXA1L, HSD17B12, OXER1 CTSK 3925/4885CTSS 3911/4885CTSL 2271/4885
US-20170327519-A1 OXABOROLE ESTERS AND USES THEREOF OXA1L, HSD17B12, OXER1 CTSK 3925/4885CTSS 3911/4885CTSL 2271/4885
US-10562921-B2 Oxaborole esters and uses thereof OXA1L, HSD17B12, OXER1 CTSK 3925/4885CTSS 3911/4885CTSL 2271/4885

“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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