SCHEMBL17254396

SCHEMBL17254396

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nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CYP2D6 P10635 1/20 0.36
MLYCD O95822 7/20 0.31

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
SCHEMBL18546129 1.00 HDAC3 (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL16716801 0.87 HDAC3 (0.36) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL10159204 0.87 HDAC3 (0.36) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL12252983 0.87 HDAC3 (0.36) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL24445633 0.81 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL16716800 0.78 HDAC3 (0.39) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL12252985 0.78 HDAC3 (0.39) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL16716804 0.78 HDAC3 (0.39) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL27200152 0.77 SLC6A2 (0.31) CYP2D6
SCHEMBL11605695 0.73 MGAM (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4356736-A2 SYNTHESIS OF BORONATE SALTS Melinta Therapeutics, Inc. (US) 2024-04-24 EP disclosed
EP-3604316-B1 SYNTHESIS OF BORONATE SALTS MELINTA THERAPEUTICS INC (US) 2023-12-06 EP disclosed
US-10669292-B2 Synthesis of boronate salts and uses thereof REMPEX PHARMACEUTICALS, INC. (US) 2020-06-02 US disclosed
EP-3604316-A1 SYNTHESIS OF BORONATE SALTS Rempex Pharmaceuticals, Inc. (US) 2020-02-05 EP disclosed
US-20200031851-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF MELINTA SUBSIDIARY CORP. 2020-01-30 US disclosed
US-10385074-B2 Synthesis of boronate salts and uses thereof REMPEX PHARMACEUTICALS, INC. (US) 2019-08-20 US disclosed
EP-3140310-B1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF REMPEX PHARMACEUTICALS INC (US) 2019-08-07 EP disclosed
US-20170057979-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF MELINTA SUBSIDIARY CORP. 2017-03-02 US disclosed
US-20170057979-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF MELINTA SUBSIDIARY CORP. 2017-03-02 US disclosed
WO-2015171430-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF REMPEX PHARMACEUTICALS, INC. (US) 2015-11-12 WO 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-20200031851-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF BTD, BCL6B, BRI3BP HDAC3 2948/4885HDAC1 2341/4885HDAC2 2028/4885
US-20170057979-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF BTD, BCL6B, BRI3BP HDAC3 2948/4885HDAC1 2341/4885HDAC2 2028/4885
US-10669292-B2 Synthesis of boronate salts and uses thereof BTD, BCL6B, BRI3BP HDAC3 2948/4885HDAC1 2341/4885HDAC2 2028/4885
US-10385074-B2 Synthesis of boronate salts and uses thereof BTD, BCL6B, BRI3BP HDAC3 2948/4885HDAC1 2341/4885HDAC2 2028/4885

“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.