SCHEMBL26999914

SCHEMBL26999914

CC(C)N1CCC[C@H]1COCCCCCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.39
▸ SPHK1 Q9NYA1 1/20 0.36
▸ ACE P12821 2/20 0.35
▸ REN P00797 1/20 0.35
▸ LTA4H P09960 4/20 0.34
▸ PLA2G2C Q5R387 1/20 0.33
▸ TSHR P16473 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ PMP22 Q01453 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ PLA2G4B P0C869 1/20 0.32
▸ GPR84 Q9NQS5 2/20 0.32
▸ PPARG P37231 2/20 0.32
▸ PPARD Q03181 2/20 0.32
▸ PPARA Q07869 2/20 0.32
▸ TBXA2R P21731 1/20 0.32
▸ SLC22A6 Q4U2R8 1/20 0.32
▸ SLC22A8 Q8TCC7 1/20 0.32

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
SCHEMBL26208264 0.99 CHRM3 (0.43) CHRM3ALDH1A1SPHK1ACEREN
SCHEMBL26999903 0.90 CHRM3 (0.45) CHRM3ACERENLTA4HLMNA
SCHEMBL26208260 0.90 CHRM3 (0.45) CHRM3ACERENLTA4HLMNA
SCHEMBL26724271 0.89 CHRM3 (0.40) CHRM3SPHK1
SCHEMBL26724270 0.88 CHRM3 (0.41) CHRM3SPHK1
SCHEMBL26205578 0.86 CHRM3 (0.41) CHRM3ACERENLTA4HLMNA
SCHEMBL26727407 0.86 CHRM3 (0.41) CHRM3ACERENLTA4HLMNA
SCHEMBL26209373 0.85 CHRM3 (0.41) CHRM3ALDH1A1ACERENLTA4H
SCHEMBL26724256 0.82 CHRM3 (0.42) CHRM3
SCHEMBL26208635 0.81 CHRM3 (0.46) CHRM3ACEREN

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-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 — — 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-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS CHRM3 179/4885ALDH1A1 4236/4885SPHK1 3192/4885

“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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