SCHEMBL21882037

SCHEMBL21882037

N#Cc1ccc(C(=O)NN2CCNCC2)nc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.42
PRKAA2 P54646 2/20 0.40
AR P10275 1/20 0.40
PRKCB P05771 1/20 0.39
LRRK2 Q5S007 1/20 0.39
DPP7 Q9UHL4 1/20 0.38
SCN7A Q01118 1/20 0.38
KCNH2 Q12809 1/20 0.38
SCN9A Q15858 1/20 0.38
CCR6 P51684 1/20 0.38
NAAA Q02083 1/20 0.38
BACE1 P56817 1/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38

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
Trifluoroacetic Acid SCHEMBL21819638 0.92 IRAK4 (0.41) EGLN1DPP7CCR6BACE1DPP4
SCHEMBL21882372 0.82 CNR1 (0.48) KCNH2
SCHEMBL21819489 0.78 MEN1 (0.48)
SCHEMBL21882044 0.77 KMT2A (0.49) SCN7AKCNH2SCN9A
SCHEMBL19661273 0.76 PRKAA2 (0.52) EGLN1PRKAA2NAAA
SCHEMBL15922805 0.75 EGLN1 (0.51) EGLN1LRRK2NAAABACE1
Trifluoroacetic Acid SCHEMBL21819626 0.74 CNR1 (0.42) KCNH2BACE1
SCHEMBL25411521 0.74 L3MBTL1 (0.60)
Trifluoroacetic Acid SCHEMBL21819534 0.74 KMT2A (0.45) SCN7AKCNH2SCN9ABACE1
SCHEMBL20575339 0.73 EGLN1 (0.54) EGLN1BACE1

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-11166942-B2 Inhibitors of integrated stress response pathway Praxis Biotech LLC (US) 2021-11-09 US disclosed
US-20200101047-A1 INHIBITORS OF INTEGRATED STRESS RESPONSE PATHWAY Praxis Biotech LLC 2020-04-02 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-11166942-B2 Inhibitors of integrated stress response pathway ATF4, DDIT3, ATF1 EGLN1 2714/4885PRKAA2 162/4885AR 3777/4885
US-20200101047-A1 INHIBITORS OF INTEGRATED STRESS RESPONSE PATHWAY ATF4, DDIT3, ATF1 EGLN1 2714/4885PRKAA2 162/4885AR 3777/4885

“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.