SCHEMBL24043473

SCHEMBL24043473

O=C(NC12CC(NC(=O)[C@H]3C[C@@H](O)c4cc(Cl)ccc4O3)(C1)C2)c1cnn(-c2ccc(Cl)c(F)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 2/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ NFKB2 Q00653 1/20 0.32
▸ RELA Q04206 1/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ MAPK8 P45983 1/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ NR1H4 Q96RI1 1/20 0.32

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
SCHEMBL22617387 1.00 ATF4 (0.33) ATF4NPC1MAPTNFKB1RAB9A
SCHEMBL29495415 1.00 ATF4 (0.33) ATF4NPC1MAPTNFKB1RAB9A
SCHEMBL29409133 0.89 ATF4 (0.36) ATF4MAPK8MAPK10
SCHEMBL29409140 0.89 ATF4 (0.36) ATF4MAPK8MAPK10
SCHEMBL22614213 0.89 ATF4 (0.36) ATF4MAPK8MAPK10
SCHEMBL22614116 0.89 ATF4 (0.36) ATF4MAPK8MAPK10
SCHEMBL22622021 0.89 CHRM1 (0.32) ATF4NR1H4
SCHEMBL22617249 0.88 MAPK8 (0.41) ATF4NPC1MAPTNFKB1RAB9A
SCHEMBL29495390 0.88 MAPK8 (0.41) ATF4NPC1MAPTNFKB1RAB9A
SCHEMBL22617413 0.87 MAOB (0.37) ATF4NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018133-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-01-18 — — US disclosed
US-20210363136-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2021-11-25 — — US disclosed
WO-2020223536-A1 SUBSTITUTED CYCLOLAKYLS AS MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2020-11-05 — — WO 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-20210363136-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885NPC1 1292/4885MAPT 3370/4885
US-20240018133-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885NPC1 1292/4885MAPT 3370/4885

“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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