SCHEMBL24110239

SCHEMBL24110239

CN(C)C1CC(n2ccc3ncncc32)C1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 4/20 0.37
RPS6KA5 O75582 6/20 0.35
RPS6KA4 O75676 3/20 0.35
EGFR P00533 2/20 0.32
MAP4K4 O95819 1/20 0.31
CDK4 P11802 1/20 0.30
CDK6 Q00534 1/20 0.30

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
SCHEMBL24110608 0.80 RPS6KA5 (0.35) IRAK4RPS6KA5RPS6KA4EGFR
SCHEMBL24109815 0.78 RPS6KA5 (0.41) IRAK4RPS6KA5RPS6KA4
SCHEMBL24110237 0.77 MKNK2 (0.39) IRAK4EGFRCDK4CDK6
SCHEMBL24110132 0.76 RPS6KA5 (0.35) IRAK4RPS6KA5RPS6KA4EGFR
SCHEMBL24110238 0.75 MAPT (0.39) CDK4CDK6
SCHEMBL24110147 0.72 CDC7 (0.35) CDK4CDK6
SCHEMBL24110242 0.72 ELANE (0.38) IRAK4
SCHEMBL24109904 0.68 DRD2 (0.49) CDK4
SCHEMBL24109896 0.66 HRH3 (0.31)
SCHEMBL256382 0.66 RPS6KA5 (0.45) RPS6KA5RPS6KA4EGFR

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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
WO-2021252692-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2021-12-16 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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF GAP43, SLC18A2, PNMT IRAK4 4512/4885RPS6KA5 1745/4885RPS6KA4 1440/4885

“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.