SCHEMBL31314871

SCHEMBL31314871

CC1CCN(C=O)CC1O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34

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
SCHEMBL6632672 0.80 PDE4B (0.31)
SCHEMBL5515534 0.80 GAA (0.31)
SCHEMBL765487 0.78
SCHEMBL209084 0.78
SCHEMBL1307795 0.78
Hydrochloric Acid SCHEMBL28644266 0.76 GPR119 (0.30)
SCHEMBL13818488 0.73
SCHEMBL11898330 0.73
SCHEMBL3818094 0.73
SCHEMBL87239 0.72

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-20250049814-A1 5-AZAINDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2025-02-13 US claimed
US-12194051-B2 5-azaindazole derivatives as adenosine receptor antagonists MERCK PATENT GMBH (DE) 2025-01-14 US claimed
US-20250049814-A1 5-AZAINDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2025-02-13 US disclosed
US-12194051-B2 5-azaindazole derivatives as adenosine receptor antagonists MERCK PATENT GMBH (DE) 2025-01-14 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 (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-20250049814-A1 5-AZAINDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS ADORA2A, ADORA2B, ADORA1 CA1 4650/4885CA2 2534/4885CA4 4411/4885
US-12194051-B2 5-azaindazole derivatives as adenosine receptor antagonists ADORA2A, ADORA2B, ADORA1 CA1 4650/4885CA2 2534/4885CA4 4411/4885

“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.