SCHEMBL22628192

SCHEMBL22628192

C=C(CCNC(=O)c1ccc(C)cn1)NC(=O)COc1ccc(Cl)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.43
▸ ATF4 P18848 8/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.40
▸ GCGR P47871 3/20 0.39
▸ HDAC1 Q13547 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
SCHEMBL25796909 0.94 ALDH1A1 (0.46) ALDH1A1ATF4KMT2AMEN1RXFP1
SCHEMBL22627579 0.91 ATF4 (0.42) ALDH1A1ATF4RXFP1GCGR
SCHEMBL22627706 0.91 ATF4 (0.42) ALDH1A1ATF4
SCHEMBL25809433 0.91 ATF4 (0.47) ALDH1A1ATF4KMT2AMEN1GCGR
SCHEMBL25814579 0.91 ATF4 (0.43) ALDH1A1ATF4GCGR
SCHEMBL22628180 0.90 NPC1 (0.46) ALDH1A1ATF4RXFP1
SCHEMBL22628207 0.89 ATF4 (0.41) ALDH1A1ATF4RXFP1GCGR
SCHEMBL22956260 0.88 ATF4 (0.41) ALDH1A1ATF4GCGR
SCHEMBL25804558 0.88 ALDH1A1 (0.42) ALDH1A1ATF4RXFP1
SCHEMBL25817460 0.88 ALDH1A1 (0.42) ALDH1A1ATF4KMT2AMEN1RXFP1

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-10913727-B2 Modulators of the integrated stress pathway ABBVIE INC. (US) 2021-02-09 — — US disclosed
US-20200345727-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-05 — — 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-10913727-B2 Modulators of the integrated stress pathway ATF4, ATF1, DDIT3 ALDH1A1 3433/4885ATF4 1/4885KMT2A 4320/4885
US-20200345727-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ALDH1A1 3433/4885ATF4 1/4885KMT2A 4320/4885

“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.

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