SCHEMBL2790267

SCHEMBL2790267

O=C(N[C@@H](Cc1cccc(C(=O)O)c1O)B(O)O)c1cncnc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 6/20 0.45
HMGB1 P09429 1/20 0.39
CTSL P07711 1/20 0.39
PSMB5 P28074 7/20 0.35
PSMB8 P28062 5/20 0.35
PSMB11 A5LHX3 1/20 0.35
PSMA7 O14818 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMA1 P25786 1/20 0.35
PSMA2 P25787 1/20 0.35
PSMA3 P25788 1/20 0.35
PSMA4 P25789 1/20 0.35
PSMB9 P28065 1/20 0.35
PSMA5 P28066 1/20 0.35
PSMB4 P28070 1/20 0.35
PSMB6 P28072 1/20 0.35
LONP1 P36776 1/20 0.35
PSMB10 P40306 1/20 0.35
PSMB3 P49720 1/20 0.35
PSMB2 P49721 1/20 0.35

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
SCHEMBL13364307 1.00 CTRB1 (0.45) CTRB1HMGB1CTSLPSMB5PSMB8
SCHEMBL2790181 0.89 CTRB1 (0.46) CTRB1PSMB5PSMB8
SCHEMBL13364075 0.87 CTRB1 (0.49) CTRB1HMGB1PSMB5PSMB8
SCHEMBL2791228 0.87 CTRB1 (0.49) CTRB1HMGB1PSMB5PSMB8
SCHEMBL2786862 0.87 CTRB1 (0.60) CTRB1HMGB1PSMB5PSMB8
SCHEMBL13839315 0.87 CTRB1 (0.60) CTRB1HMGB1PSMB5PSMB8
SCHEMBL12944814 0.86 CTRB1 (0.41) CTRB1HMGB1PSMB5PSMB8PSMB11
Hydrochloric Acid SCHEMBL2871029 0.85 CTRB1 (0.40) CTRB1HMGB1PSMB5PSMB8PSMB11
SCHEMBL2789280 0.85 CTRB1 (0.51) CTRB1HMGB1PSMB5PSMB8
SCHEMBL13839291 0.85 CTRB1 (0.51) CTRB1HMGB1PSMB5PSMB8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100120715-A1 BETA-LACTAMASE INHIBITORS PROTEZ PHARMACEUTICALS, INC. 2010-05-13 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-20100120715-A1 BETA-LACTAMASE INHIBITORS GANAB, BPGM, BLVRB CTRB1 196/4885HMGB1 1428/4885CTSL 435/4885

“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.