SCHEMBL22684362

SCHEMBL22684362

O=C(O)NC(c1nc2c(F)cccc2[nH]1)C1CCCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 9/20 0.46
RIPK1 Q13546 1/20 0.39
EGLN1 Q9GZT9 1/20 0.38
PYGL P06737 1/20 0.38
PDE10A Q9Y233 1/20 0.38
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
CTSS P25774 1/20 0.36
AAK1 Q2M2I8 2/20 0.35
DGAT1 O75907 1/20 0.35
ADORA2A P29274 1/20 0.35
KCNH2 Q12809 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL22684407 0.89 PARP1 (0.39) PARP1EGLN1PDE10AHCRTR1HCRTR2
SCHEMBL23025856 0.84 AAK1 (0.53) PARP1RIPK1AAK1LMNASMN1; SMN2
SCHEMBL22684369 0.83 AR (0.42) PARP1RIPK1PYGLPDE10ACTSS
SCHEMBL23026013 0.83 AR (0.42) PARP1RIPK1PYGLPDE10ACTSS
SCHEMBL22683878 0.82 PARP1 (0.38) PARP1AAK1
SCHEMBL26681562 0.81 PARP1 (0.41) PARP1RIPK1PYGLPDE10AHCRTR1
SCHEMBL22683934 0.81 CTSS (0.48) PARP1PDE10ACTSSSMN1; SMN2
SCHEMBL22684276 0.78 PARP1 (0.45) PARP1RIPK1EGLN1PDE10AAAK1
SCHEMBL22683875 0.78 TRPV4 (0.39) PARP1CTSS
SCHEMBL30432688 0.78 TRPV4 (0.39) PARP1CTSS

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
US-20210053952-A1 Fused Imidazole Derivatives as IL-17 Modulators UCB Biopharma SRL (BE) 2021-02-25 US claimed
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 PARP1 3074/4885RIPK1 457/4885EGLN1 2412/4885
US-20210053952-A1 Fused Imidazole Derivatives as IL-17 Modulators IL17A, IL2, IL23R PARP1 3074/4885RIPK1 457/4885EGLN1 2412/4885

“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.