SCHEMBL27248488

SCHEMBL27248488

NC(=O)c1ccc2c(ccn2Cc2ccc(B(O)O)cc2)c1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLAU P00749 5/20 0.60
PLG P00747 2/20 0.60
HDAC8 Q9BY41 9/20 0.51
HDAC6 Q9UBN7 9/20 0.51
HDAC11 Q96DB2 2/20 0.51
HDAC1 Q13547 8/20 0.50
HDAC2 Q92769 8/20 0.50
HDAC3 O15379 7/20 0.50
HDAC10 Q969S8 4/20 0.48
HDAC9 Q9UKV0 2/20 0.48
HDAC4 P56524 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
PLA2G4A P47712 1/20 0.44

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
SCHEMBL30067019 1.00 PLAU (0.60) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL28247458 0.84 PLAU (0.62) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL221369 0.82 PLAU (0.60) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL29424817 0.81 PLAU (0.59) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL22547752 0.81 PLAU (0.59) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL15612752 0.81 PLAU (0.59) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL22533790 0.81 PLAU (0.59) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL3891994 0.80 PLAU (0.60) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL15612769 0.78 PLAU (0.55) PLAUPLGHDAC8HDAC6HDAC11
SCHEMBL12472875 0.78 PLAU (0.74) PLAUPLGHDAC8HDAC6HDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029744-B2 Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors RIBOSCIENCE LLC (US) 2024-07-09 US disclosed
US-12029744-B2 Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors RIBOSCIENCE LLC (US) 2024-07-09 US disclosed
US-12029744-B2 Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors RIBOSCIENCE LLC (US) 2024-07-09 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-12029744-B2 Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors ENPP1, ENPP3, SMPD1 PLAU 2142/4885PLG 1766/4885HDAC8 1736/4885

“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.