SCHEMBL26199374

SCHEMBL26199374

Cc1n[nH]c(C)c1-c1cc(N2CCOC[C@H]2C)nc2c(Br)cnn12

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ATR Q13535 18/20 0.47
ATRIP Q8WXE1 5/20 0.40
PDE4D Q08499 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.36

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
SCHEMBL25160207 0.89 ATR (0.47) ATRATRIPPDE4D
SCHEMBL25160195 0.81 ATR (0.53) ATRATRIPPDE4DPIK3C3
SCHEMBL26199927 0.81 ATR (0.46) ATRATRIPPDE4D
SCHEMBL25908696 0.81 MAP3K7 (0.44)
SCHEMBL25405252 0.80 ATR (0.56) ATRATRIPPDE4D
SCHEMBL25405257 0.80 ATR (0.56) ATRATRIPPDE4D
SCHEMBL26200244 0.80 ATR (0.44) ATRATRIPPDE4D
SCHEMBL25160399 0.79 ATR (0.47) ATRATRIPPIK3C3
SCHEMBL25407988 0.78 ATR (0.51) ATRATRIP
SCHEMBL25407273 0.78 PDCD1 (0.46) ATRATRIP

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-20230271968-A1 PYRAZOLOPYRIMIDINE COMPOUND USED AS ATR KINASE INHIBITOR BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2023-08-31 US disclosed
US-20230271968-A1 PYRAZOLOPYRIMIDINE COMPOUND USED AS ATR KINASE INHIBITOR BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2023-08-31 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 (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-20230271968-A1 PYRAZOLOPYRIMIDINE COMPOUND USED AS ATR KINASE INHIBITOR ATR, CHEK1, CHEK2 ATR 1/4885ATRIP 4/4885PDE4D 2952/4885

“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.