SCHEMBL26301075

SCHEMBL26301075

Cc1nc(I)c2c(C3(S(C)(=O)=O)CC3)cc(N3CC4CCC(C3)O4)nn12

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ATR Q13535 2/20 0.41
MAP3K7 O43318 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CA P42336 1/20 0.30

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
SCHEMBL25406413 0.91 ATR (0.41) ATRMAP3K7MTORPIK3CA
SCHEMBL25405929 0.91 ATR (0.41) ATRMAP3K7MTORPIK3CA
SCHEMBL26301096 0.84 ATR (0.37) ATRMAP3K7
SCHEMBL25407695 0.80 ATR (0.49) ATR
SCHEMBL25408256 0.80 ATR (0.49) ATR
SCHEMBL26289452 0.72 ATR (0.44) ATRMTORPIK3CA
SCHEMBL25405924 0.72 ATR (0.44) ATRMTORPIK3CA
SCHEMBL25410054 0.71 ATR (0.43) ATRMAP3K7MTORPIK3CA
SCHEMBL25405358 0.71 ATR (0.43) ATRMAP3K7MTORPIK3CA
SCHEMBL26290771 0.71 ATR (0.44) ATRMAP3K7MTORPIK3CA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295166-A1 ATR INHIBITORS AND USES THEREOF ANTENGENE DISCOVERY LIMITED (CN) 2023-09-21 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-20230295166-A1 ATR INHIBITORS AND USES THEREOF ATR, CHEK1, CHEK2 ATR 1/4885MAP3K7 279/4885MTOR 943/4885

“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.