SCHEMBL17154184

SCHEMBL17154184

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nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.34
POLB P06746 1/20 0.33
CHRM2 P08172 12/20 0.31
CHRM4 P08173 12/20 0.31
CHRM5 P08912 12/20 0.31
CHRM1 P11229 12/20 0.31
CHRM3 P20309 12/20 0.31

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
SCHEMBL468848 0.87 ATM (0.42) ATMPOLBCHRM2CHRM4CHRM5
SCHEMBL4258841 0.87 ATM (0.42) ATMPOLBCHRM2CHRM4CHRM5
SCHEMBL4432180 0.87 ATM (0.42) ATMPOLBCHRM2CHRM4CHRM5
SCHEMBL4251630 0.87 ATM (0.42) ATMPOLBCHRM2CHRM4CHRM5
SCHEMBL4254075 0.87 ATM (0.42) ATMPOLBCHRM2CHRM4CHRM5
SCHEMBL4258297 0.87 ATM (0.42) ATMPOLBCHRM2CHRM4CHRM5
SCHEMBL4258300 0.87 ATM (0.42) ATMPOLBCHRM2CHRM4CHRM5
SCHEMBL11770755 0.83 PIK3CA (0.37) ATMPOLB
Zinc Ion SCHEMBL11772243 0.82 ATM (0.32) ATMPOLB
SCHEMBL3463049 0.80 MMP2 (0.41) POLB

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-9605022-B2 Macrocyclic compounds for inhibition of inhibitors of apoptosis ENSEMBLE THERAPEUTICS CORPORATION (US) 2017-03-28 US disclosed
US-20150284427-A1 MACROCYCLIC COMPOUNDS FOR INHIBITION OF INHIBITORS OF APOPTOSIS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-08 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-20150284427-A1 MACROCYCLIC COMPOUNDS FOR INHIBITION OF INHIBITORS OF APOPTOSIS BAX, API5, BCL2 ATM 700/4885POLB 2108/4885CHRM2 4873/4885

“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.