SCHEMBL23630564

SCHEMBL23630564

CNc1ncnc2c1c(-c1ccc3cc(OC4CC4)ccc3c1)nn2CC(C)(C)O

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRKD3 O94806 1/20 0.61
▸ KCNH2 Q12809 7/20 0.53
▸ SRC P12931 7/20 0.46
▸ ABL1 P00519 1/20 0.44
▸ LCK P06239 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
SCHEMBL32659748 1.00 PRKD3 (0.61) PRKD3KCNH2SRCABL1LCK
SCHEMBL23630581 0.89 SRC (0.53) PRKD3KCNH2SRCABL1LCK
SCHEMBL32659753 0.89 SRC (0.53) PRKD3KCNH2SRCABL1LCK
SCHEMBL17962901 0.87 PRKD3 (0.62) PRKD3KCNH2SRCABL1LCK
SCHEMBL17962892 0.87 PRKD3 (0.78) PRKD3KCNH2SRCABL1LCK
SCHEMBL23630546 0.82 PRKD3 (0.42) PRKD3KCNH2SRCABL1
SCHEMBL32659767 0.82 PRKD3 (0.42) PRKD3KCNH2SRCABL1
SCHEMBL21165331 0.79 PRKD3 (0.66) PRKD3KCNH2SRCABL1LCK
SCHEMBL17962812 0.79 KCNH2 (0.67) PRKD3KCNH2SRCABL1LCK
SCHEMBL17963662 0.78 KCNH2 (0.64) PRKD3KCNH2SRCABL1LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230125057-A1 Modified Pyrrolo- and Pyrazolo- Pyrimidines for Prostate Cancer Therapy UNIVERSITY OF WASHINGTON 2023-04-20 — — US disclosed
WO-2021142170-A1 MODIFIED PYRROLO- AND PYRAZOLO- PYRIMIDINES FOR PROSTATE CANCER THERAPY UNIVERSITY OF WASHINGTON (US) 2021-07-15 — — 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-20230125057-A1 Modified Pyrrolo- and Pyrazolo- Pyrimidines for Prostate Cancer Therapy PDK2, PDK1, PC PRKD3 355/4885KCNH2 4377/4885SRC 1546/4885

“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.

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