SCHEMBL22622716

SCHEMBL22622716

O=C(COc1ccccc1)NC12CCC(C3CCCCCC(I)CCCC3)(CC1)CC2

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 8/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ RAB9A P51151 1/20 0.42
▸ HPGD P15428 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
SCHEMBL23624601 0.86 ATF4 (0.48) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL19577632 0.83 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL22990649 0.83 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL22990531 0.83 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL19577718 0.83 ATF4 (0.54) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL23624503 0.81 ATF4 (0.51) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL23624531 0.80 ATF4 (0.50) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL23624603 0.80 ATF4 (0.50) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL23624613 0.80 ATF4 (0.50) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL22627624 0.73 ATF4 (0.56) ATF4SMN1; SMN2ALDH1A1LMNAKMT2A

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-20200347033-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC 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 (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-20200347033-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, IRF3 ATF4 1/4885SMN1; SMN2 2892/4885ALDH1A1 2905/4885

“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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