SCHEMBL22684085

SCHEMBL22684085

Nc1c(NC(=O)O)ccc(Br)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.41
▸ KCNQ3 O43525 4/20 0.38
▸ KCNQ2 O43526 4/20 0.38
▸ CA1 P00915 6/20 0.37
▸ CA2 P00918 6/20 0.37
▸ CA9 Q16790 3/20 0.35
▸ HDAC1 Q13547 2/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33

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
SCHEMBL28458867 0.77 KCNQ3 (0.41) KCNQ3KCNQ2RXFP1HTTNPC1
SCHEMBL27615922 0.75 HTT (0.41) KCNQ3KCNQ2HDAC1HTTRAB9A
SCHEMBL21468519 0.75 KMT2A (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL15348368 0.75 KCNQ2 (0.59) KCNQ3KCNQ2ALDH1A1KMT2AMEN1
SCHEMBL3415512 0.74 KMT2A (0.49) HTTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL15300145 0.74 ALDH1A1 (0.45) KCNQ3KCNQ2CA1CA2CA9
SCHEMBL30620243 0.73 CA1 (0.33) KIF11CA1CA2
SCHEMBL27298134 0.73 CA1 (0.33) KIF11CA1CA2
SCHEMBL14157169 0.72 CASP7 (0.42) CA1CA2CA9RXFP1ALDH1A1
SCHEMBL31437631 0.70 KCNQ2 (0.41) KCNQ3KCNQ2CA1CA2CA9

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 4 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
US-20210053952-A1 Fused Imidazole Derivatives as IL-17 Modulators UCB Biopharma SRL (BE) 2021-02-25 — — US disclosed
EP-3740478-A1 FUSED IMIDAZOLE DERIVATIVES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2020-11-25 — — EP 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-11472794-B2 Fused imidazole derivatives as IL-17 modulators IL17A, IL2, IL23R KIF11 3922/4885KCNQ3 2343/4885KCNQ2 1620/4885
US-20210053952-A1 Fused Imidazole Derivatives as IL-17 Modulators IL17A, IL2, IL23R KIF11 3922/4885KCNQ3 2343/4885KCNQ2 1620/4885

“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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