SCHEMBL21882075

SCHEMBL21882075

NC1CCN(NC(=O)c2ccc3cc(Cl)ccc3n2)CC1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATF4 P18848 8/20 0.56
CNR1 P21554 2/20 0.45
CNR2 P34972 6/20 0.44
HTR7 P34969 1/20 0.42
HRH3 Q9Y5N1 1/20 0.40
PAK4 O96013 1/20 0.40
SCN9A Q15858 1/20 0.40
F10 P00742 1/20 0.39

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 SCHEMBL21819604 0.93 ATF4 (0.55) ATF4CNR1CNR2HTR7PAK4
SCHEMBL23920505 0.87 ATF4 (0.56) ATF4CNR1CNR2HTR7SCN9A
SCHEMBL30053477 0.87 ATF4 (0.55) ATF4CNR1CNR2HTR7SCN9A
SCHEMBL24997307 0.87 ATF4 (0.55) ATF4CNR1CNR2HTR7SCN9A
SCHEMBL28584317 0.85 ATF4 (0.54) ATF4CNR1CNR2HTR7HRH3
SCHEMBL21819743 0.85 ATF4 (0.63) ATF4CNR1CNR2HTR7SCN9A
SCHEMBL24997256 0.83 ATF4 (0.52) ATF4CNR1CNR2F10
SCHEMBL30054248 0.83 ATF4 (0.52) ATF4CNR1CNR2F10
SCHEMBL21882371 0.83 ATF4 (0.53) ATF4CNR1CNR2SCN9A
SCHEMBL28722608 0.83 ATF4 (0.54) ATF4CNR1CNR2HTR7SCN9A

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 ATF4 1/4885CNR1 2950/4885CNR2 2686/4885
US-20200101047-A1 INHIBITORS OF INTEGRATED STRESS RESPONSE PATHWAY ATF4, DDIT3, ATF1 ATF4 1/4885CNR1 2950/4885CNR2 2686/4885

“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.