SCHEMBL2299412

SCHEMBL2299412

O=C(O)Cc1ccc2c(c1)B(O)OC2

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA12 O43570 11/20 0.60
CA1 P00915 11/20 0.60
CA2 P00918 11/20 0.60
CA9 Q16790 11/20 0.60
CA4 P22748 6/20 0.60

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
SCHEMBL12383367 0.88 CA1 (0.53) CA12CA1CA2CA9CA4
SCHEMBL1233465 0.82 CA12 (0.55) CA12CA1CA2CA9CA4
SCHEMBL22898437 0.82 CA1 (0.53) CA12CA1CA2CA9CA4
SCHEMBL20607992 0.81 CA1 (0.54) CA12CA1CA2CA9CA4
SCHEMBL20607758 0.81 CA1 (0.60) CA12CA1CA2CA9CA4
SCHEMBL1232043 0.79 CA12 (0.54) CA12CA1CA2CA9CA4
SCHEMBL12383669 0.79 CA1 (0.55) CA12CA1CA2CA9CA4
SCHEMBL22847886 0.79 CA1 (0.57) CA12CA1CA2CA9CA4
SCHEMBL12383636 0.79 CA1 (0.57) CA12CA1CA2CA9CA4
SCHEMBL12475507 0.79 ROCK2 (0.64) CA12CA1CA2CA9CA4

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-20110207701-A1 BORON-CONTAINING SMALL MOLECULES AS ANTIPROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC. (US) 2011-08-25 US disclosed
US-20110207701-A1 BORON-CONTAINING SMALL MOLECULES AS ANTIPROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC. (US) 2011-08-25 US disclosed
US-20110207701-A1 BORON-CONTAINING SMALL MOLECULES AS ANTIPROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC. (US) 2011-08-25 US disclosed
WO-2011022337-A1 BORON-CONTAINING SMALL MOLECULES AS ANTIPROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC. (US) 2011-02-24 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 (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-20110207701-A1 BORON-CONTAINING SMALL MOLECULES AS ANTIPROTOZOAL AGENTS BTD, BAD, BRI3BP CA12 1698/4885CA1 3017/4885CA2 321/4885

“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.