SCHEMBL21116448

SCHEMBL21116448

O=C(COc1ccc(Cl)c(F)c1)NCC[C@H](O)CC(=O)NCc1ccc(C(F)(F)F)cn1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ATF4 P18848 14/20 0.42
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MCHR1 Q99705 1/20 0.35
BACE1 P56817 1/20 0.35

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
SCHEMBL21116587 1.00 ATF4 (0.42) ATF4ALDH1A1GLAMEN1KMT2A
SCHEMBL21116408 1.00 ATF4 (0.42) ATF4ALDH1A1GLAMEN1KMT2A
SCHEMBL21116979 0.88 ATF4 (0.43) ATF4ALDH1A1MEN1KMT2A
SCHEMBL24116715 0.88 ATF4 (0.44) ATF4ALDH1A1MEN1KMT2A
SCHEMBL24116645 0.88 ATF4 (0.44) ATF4ALDH1A1MEN1KMT2A
SCHEMBL21116588 0.88 ATF4 (0.44) ATF4ALDH1A1MEN1KMT2A
SCHEMBL21116612 0.88 LMNA (0.42) ALDH1A1MEN1KMT2A
SCHEMBL24116908 0.87 ATF4 (0.43) ATF4ALDH1A1
SCHEMBL24116975 0.87 ATF4 (0.43) ATF4ALDH1A1KMT2A
SCHEMBL24116736 0.86 ATF4 (0.39) ATF4ALDH1A1MEN1KMT2AMCHR1

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-10836725-B2 Modulators of the integrated stress pathway ABBVIE INC. (US) 2020-11-17 US disclosed
US-20190194135-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC 2019-06-27 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-10836725-B2 Modulators of the integrated stress pathway ATF4, ATF1, DDIT3 ATF4 1/4885ALDH1A1 3433/4885GLA 3741/4885
US-20190194135-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885ALDH1A1 3433/4885GLA 3741/4885

“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.