SCHEMBL19519797

SCHEMBL19519797

COCC(C)Oc1cccc2c1B(O)OC2C[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.34
DHFR P00374 2/20 0.33
DCPS Q96C86 2/20 0.33

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
SCHEMBL19519685 0.86
SCHEMBL19519476 0.86 HTT (0.32)
SCHEMBL15077418 0.84 CYP19A1 (0.32)
SCHEMBL19519696 0.84 LARS1 (0.43) MCHR1DHFRDCPS
SCHEMBL3446061 0.84 LARS1 (0.41)
SCHEMBL19519682 0.83 MAPT (0.33)
SCHEMBL3446400 0.83
SCHEMBL13035546 0.82 LARS1 (0.33)
SCHEMBL15078715 0.82
SCHEMBL15077433 0.81 LARS1 (0.31)

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-20180016285-A1 Boron-Containing Small Molecules ANACOR PHARMACEUTICALS, LLC 2018-01-18 US disclosed
US-9796735-B2 Boron-containing small molecules ANACOR PHARMACEUTICALS, INC. (US) 2017-10-24 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-20180016285-A1 Boron-Containing Small Molecules BCL6B, BLVRB, BCL6 MCHR1 2057/4885DHFR 2921/4885DCPS 1600/4885

“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.