SCHEMBL29968565

SCHEMBL29968565

CN1C(=O)C2(CCC2)c2c1cnc1ccc(-c3ccc(OCCCO)nc3)cc21

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 19/20 0.54
▸ PRKDC P78527 3/20 0.54
▸ ATR Q13535 5/20 0.43
▸ MTOR P42345 12/20 0.43
▸ PIK3CA P42336 10/20 0.43

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
SCHEMBL29968617 0.88 ATM (0.53) ATMPRKDCATRMTORPIK3CA
SCHEMBL21851110 0.87 ATM (0.63) ATMPRKDCATRMTORPIK3CA
SCHEMBL29969341 0.87 ATM (0.52) ATMPRKDCATRMTORPIK3CA
SCHEMBL29968726 0.86 ATM (0.53) ATMPRKDCATRMTORPIK3CA
SCHEMBL21513239 0.85 ATM (0.61) ATMPRKDCATRMTORPIK3CA
SCHEMBL29968606 0.85 ATM (0.61) ATMPRKDCATRMTORPIK3CA
SCHEMBL21851215 0.83 ATM (0.53) ATMPRKDCATRMTORPIK3CA
SCHEMBL21512952 0.83 ATM (0.48) ATMPRKDCATRMTORPIK3CA
SCHEMBL29969316 0.83 ATM (0.48) ATMPRKDCATRMTORPIK3CA
SCHEMBL23615854 0.83 ATM (0.57) ATMATRMTORPIK3CA

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-12187742-B2 Dual ATM and DNA-PK inhibitors for use in anti-tumor therapy XRAD THERAPEUTICS, INC. (US) 2025-01-07 — — US disclosed
US-20220315606-A1 DUAL ATM AND DNA-PK INHIBITORS FOR USE IN ANTI-TUMOR THERAPY XRAD HOLDING CAYMAN LIMITED (KY) 2022-10-06 — — 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 (2 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-20220315606-A1 DUAL ATM AND DNA-PK INHIBITORS FOR USE IN ANTI-TUMOR THERAPY ATM, CHEK2, CHEK1 ATM 1/4885PRKDC 57/4885ATR 9/4885
US-12187742-B2 Dual ATM and DNA-PK inhibitors for use in anti-tumor therapy ATM, CHEK2, CHEK1 ATM 1/4885PRKDC 57/4885ATR 9/4885

“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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