SCHEMBL25018708

SCHEMBL25018708

CC(C)c1cn(C(C)C)nc1F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
ACHE P22303 2/20 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
SCHEMBL12299844 0.76 ADORA2A (0.33) ADORA2AADORA1
SCHEMBL11957357 0.76 ADORA2A (0.33) ADORA2AADORA1
SCHEMBL20697171 0.76
SCHEMBL25019042 0.76 ADORA2A (0.37) ADORA2AADORA1ACHE
SCHEMBL18068011 0.75 ACHE (0.33) ADORA2AADORA1ACHE
SCHEMBL19887986 0.74 ADORA2A (0.40) ADORA2AADORA1
SCHEMBL23403088 0.74 GABRA1 (0.35) ADORA2AADORA1ACHE
SCHEMBL18068046 0.74 ADORA2A (0.43) ADORA2AADORA1
SCHEMBL19224382 0.74 ADORA2A (0.33) ADORA2AADORA1ACHE
SCHEMBL17452764 0.74 LRRK2 (0.39) ADORA2AADORA1ACHE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183217-A1 INHIBITORS OF LRRK2 KINASE HALIA THERAPEUTICS INC (US) 2023-06-15 US disclosed
US-11578061-B2 Inhibitors of LRRK2 kinase Halia Therapeutics, Inc. (US) 2023-02-14 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-20230183217-A1 INHIBITORS OF LRRK2 KINASE LRRK2, SNCA, PRKAR2B ADORA2A 744/4885ADORA1 826/4885ACHE 1176/4885
US-11578061-B2 Inhibitors of LRRK2 kinase LRRK2, SNCA, PRKAR2B ADORA2A 744/4885ADORA1 826/4885ACHE 1176/4885

“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.