SCHEMBL24285950

SCHEMBL24285950

Cc1c(F)cccc1-c1cc(F)c2nc(N)c(C)n2c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 10/20 0.39
▸ ABL1 P00519 5/20 0.39
▸ ADORA2A P29274 5/20 0.37
▸ ADORA1 P30542 4/20 0.37
▸ ADORA2B P29275 4/20 0.37
▸ DYRK1A Q13627 1/20 0.34
▸ GRM5 P41594 2/20 0.34
▸ PDE2A O00408 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33

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
SCHEMBL24285951 0.77 LRRK2 (0.40) LRRK2ABL1ADORA2AADORA1ADORA2B
SCHEMBL24285952 0.77 LRRK2 (0.51) LRRK2ABL1
SCHEMBL24286624 0.70 LRRK2 (0.44) LRRK2ABL1ADORA2AADORA1
SCHEMBL24285831 0.68 LRRK2 (0.48) LRRK2ABL1
SCHEMBL24286210 0.67 LRRK2 (0.52) LRRK2ABL1
SCHEMBL24286636 0.66 LRRK2 (0.55) LRRK2ABL1
SCHEMBL24285885 0.65 LRRK2 (0.41) LRRK2ABL1
SCHEMBL24286003 0.65 CDK2 (0.38) LRRK2ABL1
SCHEMBL22362945 0.65 LRRK2 (0.57) LRRK2ABL1
SCHEMBL22149192 0.64 BRD4 (0.44) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220087985-A1 2-AMINO-3-CARBONYL IMIDAZOPYRIDINE AND PYRAZOLOPYRIDINE COMPOUNDS 1ST Biotherapeutics, Inc. (KR) 2022-03-24 — — 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-20220087985-A1 2-AMINO-3-CARBONYL IMIDAZOPYRIDINE AND PYRAZOLOPYRIDINE COMPOUNDS NLRP3, NLRP1, KCNJ2 LRRK2 538/4885ABL1 966/4885ADORA2A 1419/4885

“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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