SCHEMBL23712839

SCHEMBL23712839

Cc1cc(C)n(-c2cc(N)cc(B3OC(C)(C)C(C)(C)O3)c2)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
MAPT P10636 2/20 0.37
KDM4E B2RXH2 3/20 0.36
GAA P10253 2/20 0.36
TERT O14746 1/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 2/20 0.35
IRAK4 Q9NWZ3 1/20 0.34
ALDH1A1 P00352 3/20 0.33
CYP1A2 P05177 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP2C19 P33261 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
HPGD P15428 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
SCHEMBL30345282 1.00 POLB (0.39) POLBMAPTKDM4EGAATERT
SCHEMBL29196621 0.84 TSHR (0.41) MAPTKDM4EGAATSHRSMN1; SMN2
SCHEMBL29196615 0.82 NR1I2 (0.36) MAPTKDM4EGAATSHRSMN1; SMN2
SCHEMBL23712840 0.81 IRAK4 (0.36) IRAK4
SCHEMBL30345315 0.81 IRAK4 (0.36) IRAK4
SCHEMBL23673358 0.80 IRAK4 (0.44) MAPTKDM4EGAATSHRSMN1; SMN2
SCHEMBL17629356 0.79 HTT (0.47) MAPTKDM4ETSHRSMN1; SMN2HTT
SCHEMBL19813786 0.74 LPL (0.44)
SCHEMBL23712838 0.73 TDO2 (0.33) MAPTKDM4EGAAIRAK4ALDH1A1
SCHEMBL30345421 0.73 TDO2 (0.33) MAPTKDM4EGAAIRAK4ALDH1A1

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-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 POLB 2872/4885MAPT 2467/4885KDM4E 2830/4885

“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.