SCHEMBL29969147

SCHEMBL29969147

CN1C(=O)C2(CCC2)c2c1cnc1cc(F)c(-c3cncc(NS(C)(=O)=O)c3)cc21

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 3/20 0.67
▸ ATM Q13315 2/20 0.43
▸ FGFR1 P11362 1/20 0.39
▸ FGFR2 P21802 1/20 0.39
▸ FGFR3 P22607 1/20 0.39
▸ PIK3CB P42338 1/20 0.37
▸ BRD4 O60885 1/20 0.35
▸ ATAD2 Q6PL18 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ KIT P10721 3/20 0.35
▸ PRF1 P14222 7/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ PIP4K2A P48426 1/20 0.33
▸ PIP4K2B P78356 1/20 0.33

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
SCHEMBL29629154 0.81 PRKDC (1.00) PRKDCATMPIK3CB
SCHEMBL21513069 0.81 PRKDC (1.00) PRKDCATMPIK3CB
Hydrochloric Acid SCHEMBL29629170 0.80 PRKDC (0.99) PRKDCATMPIK3CB
SCHEMBL21513294 0.80 PRKDC (0.81) PRKDCATM
SCHEMBL21513862 0.80 PRKDC (0.67) PRKDCATM
SCHEMBL21512997 0.80 PRKDC (0.65) PRKDCATM
Hydrochloric Acid SCHEMBL29969298 0.80 PRKDC (0.80) PRKDCATM
SCHEMBL21513357 0.80 PRKDC (0.82) PRKDCATMPIK3CB
Hydrochloric Acid SCHEMBL29969057 0.80 PRKDC (0.82) PRKDCATMPIK3CBKIT
Hydrochloric Acid SCHEMBL26132000 0.80 PRKDC (0.80) PRKDCATM

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 1/4885FGFR1 1527/4885
US-12187742-B2 Dual ATM and DNA-PK inhibitors for use in anti-tumor therapy ATM, CHEK2, CHEK1 PRKDC 57/4885ATM 1/4885FGFR1 1527/4885

“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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