SCHEMBL29968635

SCHEMBL29968635

CN1C(=O)C2(CC2)c2c1cnc1ccc(-c3ccc4nccnc4c3)cc21

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 3/20 0.46
▸ ATM Q13315 2/20 0.46
▸ TGFBR1 P36897 14/20 0.38
▸ ACVR1 Q04771 2/20 0.36
▸ PIK3CD O00329 1/20 0.34

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
SCHEMBL21513819 1.00 PRKDC (0.46) PRKDCATMTGFBR1ACVR1PIK3CD
SCHEMBL29968928 0.87 NPC1 (0.45) PRKDCATMACVR1PIK3CD
SCHEMBL21513256 0.87 NPC1 (0.45) PRKDCATMACVR1PIK3CD
SCHEMBL21513491 0.86 ATM (0.46) PRKDCATMACVR1
SCHEMBL29969221 0.85 ATM (0.47) PRKDCATMACVR1PIK3CD
SCHEMBL29969564 0.85 ATM (0.47) PRKDCATMACVR1PIK3CD
SCHEMBL26131176 0.85 ATM (0.47) PRKDCATMACVR1PIK3CD
SCHEMBL21513255 0.82 MTOR (0.49) PRKDCATMACVR1PIK3CD
SCHEMBL29968579 0.82 MTOR (0.49) PRKDCATMACVR1PIK3CD
SCHEMBL29969038 0.82 ATM (0.47) PRKDCATMPIK3CD

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 PRKDC 57/4885ATM 1/4885TGFBR1 1890/4885
US-12187742-B2 Dual ATM and DNA-PK inhibitors for use in anti-tumor therapy ATM, CHEK2, CHEK1 PRKDC 57/4885ATM 1/4885TGFBR1 1890/4885

“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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