SCHEMBL22613951

SCHEMBL22613951

O=C(O)NC12CC(C(=O)CNC(=O)c3ccc(Cl)c(F)c3)(C1)C2

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 2/20 0.41
▸ KCNQ2 O43526 2/20 0.41
▸ KCNE1 P15382 2/20 0.41
▸ KCNQ1 P51787 2/20 0.41
▸ KCNQ5 Q9NR82 1/20 0.41
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ HPGD P15428 3/20 0.38
▸ MAOB P27338 3/20 0.37
▸ POLB P06746 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ ATF4 P18848 2/20 0.37
▸ GPR139 Q6DWJ6 1/20 0.37
▸ IDO1 P14902 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PPARG P37231 2/20 0.36
▸ USP5 P45974 1/20 0.36

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
SCHEMBL29408954 0.85 MAPT (0.39) MAPTPPARG
SCHEMBL22613942 0.82 ATF4 (0.37) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL22613867 0.74 KCNQ3 (0.34) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL22613866 0.74 KCNQ3 (0.34) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL12462419 0.69 MAOB (0.63) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL20772312 0.68 KCNQ3 (0.56) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL19555713 0.68 ATF4 (0.58) ATF4
SCHEMBL29409005 0.68 DPP8 (0.40) KCNQ3KCNQ2KCNE1KCNQ1ATF4
SCHEMBL19569379 0.68 ATF4 (0.62) ATF4
SCHEMBL22617462 0.68 NR1H4 (0.38) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5

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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