SCHEMBL29469201

SCHEMBL29469201

NS(=O)(=O)c1ccccc1B(O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.50
CA1 P00915 11/20 0.50
CA9 Q16790 9/20 0.50
CA12 O43570 5/20 0.50
CA6 P23280 4/20 0.50
CA5A P35218 4/20 0.50
CA4 P22748 3/20 0.50
CA7 P43166 3/20 0.50
CA5B Q9Y2D0 3/20 0.50
CA14 Q9ULX7 2/20 0.50
CYP2C9 P11712 1/20 0.50
LDHA P00338 1/20 0.44
CDK2 P24941 1/20 0.44
CA3 P07451 1/20 0.39
PLA2G7 Q13093 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
STAT3 P40763 1/20 0.39

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
SCHEMBL1490894 1.00 CA2 (0.50) CA2CA1CA9CA12CA6
SCHEMBL2066500 0.82 CDK2 (0.44) CA2CA1CA9CA12CA6
SCHEMBL48859 0.80 ENPP2 (0.43)
SCHEMBL8377616 0.80 TSHR (0.46) CA6CA5ACA4CA7CA5B
SCHEMBL2557830 0.79 CDK2 (0.42) CA2CA1CA9CA12CA6
SCHEMBL3448715 0.77 CDK2 (0.41) CA2CA1CA9CA12CA6
SCHEMBL289765 0.77 PSIP1 (0.45) CA9CA12CYP2C9
SCHEMBL29670227 0.77 PSIP1 (0.45) CA9CA12CYP2C9
SCHEMBL202947 0.75 CA2 (0.70) CA2CA1CA9CA12CA6
SCHEMBL1742559 0.75 ALDH1A1 (0.50)

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-12083121-B2 Substituted piperazines as KRAS G12C inhibitors AMGEN INC. (US) 2024-09-10 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20220175782-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. 2022-06-09 US disclosed
US-11285156-B2 Substituted piperazines as KRAS G12C inhibitors AMGEN INC. (US) 2022-03-29 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 (3 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-11285156-B2 Substituted piperazines as KRAS G12C inhibitors KRAS, NRAS, HRAS CA2 3488/4885CA1 3813/4885CA9 3967/4885
US-12083121-B2 Substituted piperazines as KRAS G12C inhibitors KRAS, NRAS, HRAS CA2 3488/4885CA1 3813/4885CA9 3967/4885
US-20220175782-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS CA2 2699/4885CA1 2768/4885CA9 1481/4885

“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.