SCHEMBL23712499

SCHEMBL23712499

CC(C)Oc1cc(N)cc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
LPL P06858 7/20 0.35
LIPG Q9Y5X9 7/20 0.35
CA12 O43570 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
AAK1 Q2M2I8 1/20 0.32
F11 P03951 1/20 0.31

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
SCHEMBL30345334 1.00 CA1 (0.38) CA1CA2CA9LPLLIPG
SCHEMBL30345372 0.86 CA1 (0.37) CA1CA2CA9LPLLIPG
SCHEMBL1494491 0.86 CA1 (0.37) CA1CA2CA9LPLLIPG
SCHEMBL15649176 0.82 CA1 (0.41) CA1CA2CA9LPLLIPG
SCHEMBL19813786 0.79 LPL (0.44) CA1CA2CA9LPLLIPG
SCHEMBL14918908 0.79 NR1I2 (0.37) CA1CA2CA9LPLLIPG
SCHEMBL30345314 0.78 TP53 (0.41) CA1CA2CA9LPLLIPG
SCHEMBL23712498 0.78 TP53 (0.41) CA1CA2CA9LPLLIPG
SCHEMBL13336463 0.77 LMNA (0.38) CA1CA2CA9LPLLIPG
SCHEMBL15376138 0.76 LIPG (0.46) CA1CA2CA9LPLLIPG

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-20230126352-A1 MACROCYCLIC RIP2-KINASE INHIBITORS ONCODESIGN SA (FR) 2023-04-27 US disclosed
US-20230126352-A1 MACROCYCLIC RIP2-KINASE INHIBITORS ONCODESIGN SA (FR) 2023-04-27 US disclosed
US-20230126352-A1 MACROCYCLIC RIP2-KINASE INHIBITORS ONCODESIGN SA (FR) 2023-04-27 US disclosed
WO-2021152165-A1 MACROCYCLIC RIP2-KINASE INHIBITORS ONCODESIGN S.A. (FR) 2021-08-05 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-20230126352-A1 MACROCYCLIC RIP2-KINASE INHIBITORS RIPK2, RIPK1, RIPK3 CA1 4459/4885CA2 3767/4885CA9 4283/4885

“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.