SCHEMBL26209374

SCHEMBL26209374

CC(C)N1CCCOC(COCCC(=O)O)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.44
PDK1 Q15118 8/20 0.42
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
ERBB2 P04626 1/20 0.33
EPHA2 P29317 1/20 0.33
KDR P35968 1/20 0.33
EPHB4 P54760 1/20 0.33
CCR2 P41597 1/20 0.32
KCNH2 Q12809 1/20 0.32
ACE P12821 2/20 0.32
REN P00797 1/20 0.32
LMNA P02545 1/20 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
SCHEMBL26727069 0.92 HRH3 (0.52) HRH3PDK1ALDH1A1NPSR1ERBB2
SCHEMBL26724471 0.90 PDK1 (0.42) HRH3PDK1ALDH1A1NPSR1ERBB2
SCHEMBL27000009 0.83 PDK1 (0.44) HRH3PDK1ALDH1A1NPSR1LMNA
SCHEMBL26723898 0.82 HRH3 (0.49) HRH3PDK1NPSR1ERBB2EPHA2
SCHEMBL20179866 0.79 HRH3 (0.54) HRH3PDK1NPSR1ERBB2EPHA2
SCHEMBL26211834 0.77 ACE (0.39) CCR2KCNH2ACERENLMNA
SCHEMBL26727064 0.77 PDK1 (0.40) HRH3PDK1ALDH1A1KCNH2
SCHEMBL26209361 0.76 LMNA (0.37) ALDH1A1CCR2KCNH2ACEREN
SCHEMBL26730198 0.74 CHRM3 (0.36) HRH3KCNH2ACEREN
SCHEMBL24600547 0.74 HRH3 (0.55) HRH3PDK1ALDH1A1ERBB2EPHA2

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 HRH3 994/4885PDK1 1969/4885ALDH1A1 4236/4885
US-20230357158-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS CGAS, GLS2, GLS HRH3 994/4885PDK1 1969/4885ALDH1A1 4236/4885

“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.