SCHEMBL13544648

SCHEMBL13544648

CN1CC[C@@H](O)[C@H](C(=O)O)C1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.43
▸ SLC6A2 P23975 4/20 0.41
▸ SLC6A4 P31645 4/20 0.41
▸ SLC6A3 Q01959 4/20 0.41

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
SCHEMBL13544642 1.00 ALDH1A1 (0.43) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL13544944 0.83 SLC6A2 (0.37) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL13544941 0.83 SLC6A2 (0.37) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL15592009 0.83 ALDH1A1 (0.40) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL14593819 0.83 SLC6A2 (0.37) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL14569618 0.83 ALDH1A1 (0.46) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL14311906 0.82 SLC6A2 (0.36) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL17972972 0.80 GABRR1 (0.39) ALDH1A1
Hydrochloric Acid SCHEMBL14311983 0.80 ALDH1A1 (0.38) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL23269565 0.79 GABRR1 (0.44) ALDH1A1SLC6A2SLC6A4SLC6A3

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 4 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
WO-2023168367-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS IMMUNESENSOR THERAPEUTICS, INC. (US) 2023-09-07 — — WO disclosed
US-7645771-B2 CCR5 antagonists as therapeutic agents SMITHKLINE BEECHAM CORP. (US) 2010-01-12 — — US disclosed
US-7645771-B2 CCR5 antagonists as therapeutic agents SMITHKLINE BEECHAM CORP. (US) 2010-01-12 — — 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 ALDH1A1 4236/4885SLC6A2 298/4885SLC6A4 741/4885

“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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