SCHEMBL22613867

SCHEMBL22613867

O=C(O)NC12CC(C(=O)NC(=NO)c3ccc(Cl)c(F)c3)(C1)C2

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 2/20 0.34
▸ KCNQ2 O43526 2/20 0.34
▸ KCNE1 P15382 2/20 0.34
▸ KCNQ1 P51787 2/20 0.34
▸ KCNQ5 Q9NR82 1/20 0.34
▸ ATF4 P18848 7/20 0.34
▸ MAOB P27338 3/20 0.32
▸ IDO1 P14902 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ PTGER4 P35408 1/20 0.30
▸ S1PR1 P21453 1/20 0.30
▸ S1PR3 Q99500 1/20 0.30
▸ KMO O15229 1/20 0.30

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
SCHEMBL22613866 1.00 KCNQ3 (0.34) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL29409011 0.84 DPP8 (0.34) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL22613942 0.78 ATF4 (0.37) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL22613951 0.74 KCNQ3 (0.41) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL19555713 0.69 ATF4 (0.58) ATF4
SCHEMBL24641161 0.67 KCNQ3 (0.40) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL26116238 0.66 EPHX1 (0.50) —
SCHEMBL19555329 0.64 ATF4 (0.72) ATF4
SCHEMBL479072 0.63 TSHR (0.65) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL23358956 0.62 ATF4 (0.63) ATF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4237413-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2023-09-06 — — EP disclosed
WO-2022094244-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2022-05-05 — — WO disclosed
EP-3962906-A1 SUBSTITUTED CYCLOALKYLS AS MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2022-03-09 — — EP disclosed
US-20200347043-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-05 — — US disclosed
WO-2020223538-A1 SUBSTITUTED CYCLOALKYLS 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 (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-20200347043-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 KCNQ3 4651/4885KCNQ2 4714/4885KCNE1 4728/4885

“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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