SCHEMBL27351608

SCHEMBL27351608

CC(C)(C)OC(O)N1CCC(n2c(S(C)(=O)=O)nc3cccc(F)c32)CC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ GPR119 Q8TDV5 4/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL27349839 0.82 GPR119 (0.47) GPR119
SCHEMBL27351545 0.81 HTT (0.44) CYP11B2KDM4EALDH1A1GAAHTT
SCHEMBL27351552 0.73 CYP1A2 (0.37) ALDH1A1POLB
SCHEMBL27351573 0.70 HTT (0.36) KDM4EALDH1A1GAAHTTSMN1; SMN2
SCHEMBL27351618 0.67 CGAS (0.31) —
SCHEMBL27351563 0.67 ADORA2B (0.31) —
SCHEMBL27351538 0.67 CGAS (0.33) CYP11B2
SCHEMBL27349835 0.65 OPRM1 (0.57) GPR119
SCHEMBL27349815 0.62 GPR119 (0.49) CYP11B2SMN1; SMN2GPR119
SCHEMBL27349812 0.62 GPR119 (0.51) KDM4EALDH1A1GAAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208997-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-06-27 — — 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-20240208997-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS CGAS, STING1, IFNAR1 CYP11B2 259/4885KDM4E 2028/4885ALDH1A1 815/4885

“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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