SCHEMBL26209110

SCHEMBL26209110

CN1CCC[C@H]1COc1ccccc1CC(=O)O

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 4/20 0.62
CHRNA3 P32297 4/20 0.62
CHRNB2 P17787 2/20 0.56
CHRNA4 P43681 2/20 0.56
CHRNA5 P30532 1/20 0.56
CHRNA7 P36544 1/20 0.56
CHRNB1 P11230 1/20 0.55
CHRNB3 Q05901 1/20 0.55

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
SCHEMBL18294081 0.86 CHRNB4 (0.57) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA5
SCHEMBL18294078 0.86 CHRNB4 (0.57) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA5
SCHEMBL26209133 0.84 CHRM3 (0.50) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA5
SCHEMBL26729833 0.82 CHRNB4 (0.65) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA5
SCHEMBL8706817 0.81 CHRNB4 (0.64) CHRNB4CHRNA3CHRNB2CHRNA4CHRNB1
SCHEMBL8706812 0.81 CHRNB4 (0.64) CHRNB4CHRNA3CHRNB2CHRNA4CHRNB1
Hydrochloric Acid SCHEMBL8706666 0.80 CHRNB4 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4CHRNB1
Hydrochloric Acid SCHEMBL8706659 0.80 CHRNB4 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4CHRNB1
SCHEMBL32691652 0.79 CHRNB4 (0.67) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA5
SCHEMBL26729894 0.77 CHRNB2 (0.57) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA5

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 3 patents. 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
US-20230357158-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2023-11-09 US disclosed
WO-2023168367-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS IMMUNESENSOR THERAPEUTICS, INC. (US) 2023-09-07 WO 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-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS CHRNB4 282/4885CHRNA3 353/4885CHRNB2 158/4885
US-20230357158-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS CGAS, GLS2, GLS CHRNB4 282/4885CHRNA3 353/4885CHRNB2 158/4885

“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.