SCHEMBL24027178

SCHEMBL24027178

CCOc1cn(CC(C)(C)C)nn1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.39
▸ NEU4 Q8WWR8 1/20 0.33
▸ NEU3 Q9UQ49 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ GPR88 Q9GZN0 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
SCHEMBL24027292 0.83 HTT (0.37) HTTNEU4NEU3GPR88
SCHEMBL20650987 0.72 P2RX7 (0.47) —
SCHEMBL28711026 0.71 ADORA3 (0.34) ADORA3ADORA2AADORA1
SCHEMBL12092341 0.71 DPP4 (0.36) ADORA3ADORA2AADORA1
SCHEMBL3581966 0.71 — —
SCHEMBL22567172 0.69 — —
SCHEMBL3581963 0.69 — —
SCHEMBL17678394 0.69 GGPS1 (0.37) ADORA2AADORA1
SCHEMBL23974517 0.69 CYP19A1 (0.54) —
SCHEMBL10025991 0.68 GGPS1 (0.36) ADORA2AADORA1

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-11312713-B2 Imidazo[4,5-C]quinoline derivatives as LRRK2 inhibitors PFIZER INC. (US) 2022-04-26 — — US disclosed
US-20210355117-A1 NOVEL IMIDAZO[4,5-C]QUINOLINE DERIVATIVES AS LRRK2 INHIBITORS PFIZER (US) 2021-11-18 — — 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-11312713-B2 Imidazo[4,5-C]quinoline derivatives as LRRK2 inhibitors LRRK2, PARK7, BRCA1 HTT 342/4885NEU4 3672/4885NEU3 3225/4885
US-20210355117-A1 NOVEL IMIDAZO[4,5-C]QUINOLINE DERIVATIVES AS LRRK2 INHIBITORS LRRK2, PARK7, BRCA1 HTT 293/4885NEU4 3723/4885NEU3 3332/4885

“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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