SCHEMBL23624613

SCHEMBL23624613

O=C(COc1ccccccccc1)NC12CC(C3CCCC(C4CCCCCCCCCC4)CCC3)(C1)C2

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 10/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ LMNA P02545 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45

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
SCHEMBL23624531 1.00 ATF4 (0.50) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL23624603 1.00 ATF4 (0.50) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL23624503 0.99 ATF4 (0.51) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL19577632 0.95 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL22990649 0.95 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL19577718 0.95 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL22990531 0.95 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL23624601 0.83 ATF4 (0.48) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL19568597 0.80 ATF4 (0.56) ATF4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL22627624 0.80 ATF4 (0.56) ATF4SMN1; SMN2ALDH1A1LMNAMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210205277-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2021-07-08 — — 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 (1 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-20210205277-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885SMN1; SMN2 2486/4885ALDH1A1 3433/4885

“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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