SCHEMBL30039558

SCHEMBL30039558

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1c(F)c(Br)cc(F)c1[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.36
▸ SSTR4 P31391 1/20 0.34
▸ AAK1 Q2M2I8 1/20 0.31
▸ MAPT P10636 4/20 0.31
▸ PKM P14618 1/20 0.31
▸ MAPK1 P28482 2/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 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
SCHEMBL28458792 1.00 KCNH2 (0.36) KCNH2SSTR4AAK1MAPTPKM
SCHEMBL22684294 0.95 KCNH2 (0.35) KCNH2SSTR4AAK1
SCHEMBL19776245 0.84 KCNH2 (0.35) KCNH2SSTR4MAPTALDH1A1LMNA
SCHEMBL21459919 0.80 KCNH2 (0.34) KCNH2SSTR4ALDH1A1
SCHEMBL29835592 0.79 NR1D1 (0.33) MAPTALDH1A1LMNA
SCHEMBL18146098 0.79 NR1D1 (0.33) MAPTALDH1A1LMNA
SCHEMBL29835598 0.79 NR1D1 (0.33) MAPTALDH1A1LMNA
SCHEMBL20045607 0.79 MAPT (0.34) KCNH2SSTR4MAPTALDH1A1LMNA
SCHEMBL30059621 0.79 SSTR4 (0.39) KCNH2SSTR4MAPTALDH1A1LMNA
SCHEMBL26919345 0.76 NR1D1 (0.34) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3740478-B1 FUSED IMIDAZOLE DERIVATIVES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2023-11-01 — — EP disclosed
US-11472794-B2 Fused imidazole derivatives as IL-17 modulators UCB Biopharma SRL (BE) 2022-10-18 — — 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-11472794-B2 Fused imidazole derivatives as IL-17 modulators IL17A, IL2, IL23R KCNH2 2677/4885SSTR4 4193/4885AAK1 2070/4885

“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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