SCHEMBL29968542

SCHEMBL29968542

CN1C(=O)C2(CC2)c2c1cnc1ccc(-c3ccc4nc(Cl)ccc4c3)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 5/20 0.45
▸ ATM Q13315 4/20 0.45
▸ MTOR P42345 6/20 0.38
▸ HPGD P15428 1/20 0.37
▸ MET P08581 2/20 0.34
▸ PIK3CA P42336 7/20 0.34
▸ PIK3C2A O00443 1/20 0.34
▸ PIK3C2B O00750 1/20 0.34
▸ PIK3CD O00329 4/20 0.33
▸ ACVR1 Q04771 1/20 0.33
▸ PIK3CB P42338 2/20 0.32
▸ PIK3CG P48736 2/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ EGFR P00533 1/20 0.32
▸ HCK P08631 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ EPHB4 P54760 1/20 0.32
▸ ATR Q13535 1/20 0.32
▸ BACE1 P56817 1/20 0.32

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
SCHEMBL21513499 1.00 PRKDC (0.45) PRKDCATMMTORHPGDMET
SCHEMBL29969092 0.86 ATM (0.46) PRKDCATMMTORHPGDPIK3CA
SCHEMBL21513498 0.86 ATM (0.46) PRKDCATMMTORHPGDPIK3CA
SCHEMBL21513255 0.84 MTOR (0.49) PRKDCATMMTORMETPIK3CA
SCHEMBL29968928 0.84 NPC1 (0.45) PRKDCATMMTORHPGDPIK3CA
SCHEMBL21513256 0.84 NPC1 (0.45) PRKDCATMMTORHPGDPIK3CA
SCHEMBL29968579 0.84 MTOR (0.49) PRKDCATMMTORMETPIK3CA
SCHEMBL21513286 0.82 ATM (0.45) PRKDCATMMTORPIK3CAPIK3C2A
SCHEMBL29968839 0.82 ATM (0.45) PRKDCATMMTORPIK3CAPIK3C2A
SCHEMBL21513497 0.82 ATM (0.42) PRKDCATMMTORHPGDMET

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 1/4885MTOR 660/4885
US-12187742-B2 Dual ATM and DNA-PK inhibitors for use in anti-tumor therapy ATM, CHEK2, CHEK1 PRKDC 57/4885ATM 1/4885MTOR 660/4885

“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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