SCHEMBL21116635

SCHEMBL21116635

C=C(CCNC(=O)COc1ccc(Cl)c(F)c1)C(=O)NCc1ccc(C(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
EPHX2 P34913 2/20 0.43
NR1H4 Q96RI1 2/20 0.43
ALDH1A1 P00352 3/20 0.42
ATF4 P18848 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.40

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
SCHEMBL21116605 0.92 ADAMTS5 (0.43) ALDH1A1ATF4LMNASMN1; SMN2GAA
SCHEMBL24323059 0.90 GAA (0.53) L3MBTL1ALDH1A1ATF4LMNAGAA
SCHEMBL24322876 0.90 ATF4 (0.45) ALDH1A1ATF4LMNASMN1; SMN2GAA
SCHEMBL24324507 0.90 LMNA (0.49) ALDH1A1ATF4LMNASMN1; SMN2GAA
SCHEMBL21116655 0.88 TRPV1 (0.44) EPHX2ALDH1A1ATF4LMNASMN1; SMN2
SCHEMBL24116960 0.88 TAOK1 (0.51) ALDH1A1ATF4SMN1; SMN2
SCHEMBL21117004 0.88 KMT2A (0.47) L3MBTL1ALDH1A1ATF4SMN1; SMN2
SCHEMBL21116606 0.87 ATF4 (0.45) ALDH1A1ATF4LMNASMN1; SMN2GAA
SCHEMBL24116642 0.86 ALDH1A1 (0.47) EPHX2ALDH1A1ATF4LMNASMN1; SMN2
SCHEMBL21116431 0.86 PTPRZ1 (0.42) EPHX2NR1H4ALDH1A1ATF4LMNA

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 L3MBTL1 1651/4885EPHX2 3932/4885NR1H4 747/4885
US-20190194135-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 L3MBTL1 1651/4885EPHX2 3932/4885NR1H4 747/4885

“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.