SCHEMBL22349064

SCHEMBL22349064

Cc1ccc2ncn(C)c2c1C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 10/20 0.42
▸ DPP8 Q6V1X1 4/20 0.42
▸ HCAR1 Q9BXC0 2/20 0.31
▸ IP6K1 Q92551 1/20 0.31
▸ DYRK1A Q13627 2/20 0.31
▸ BRAF P15056 1/20 0.30

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
SCHEMBL21049576 0.77 DPP4 (0.46) DPP4DPP8HCAR1DYRK1A
SCHEMBL10673703 0.76 DPP4 (0.49) DPP4DPP8DYRK1A
SCHEMBL25702526 0.75 DPP4 (0.34) DPP4DPP8
SCHEMBL13676395 0.74 DPP4 (0.44) DPP4DPP8HCAR1DYRK1A
SCHEMBL23386882 0.71 ALDH1A1 (0.38) DPP4
SCHEMBL22349122 0.71 SLC9A1 (0.36) DPP4DPP8DYRK1A
SCHEMBL25669387 0.71 DPP4 (0.42) DPP4DPP8DYRK1A
SCHEMBL27051515 0.71 DPP4 (0.42) DPP4DPP8DYRK1A
SCHEMBL16626055 0.70 POLB (0.38) DPP4DPP8DYRK1A
SCHEMBL21986846 0.70 DPP4 (0.51) DPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2023-06-29 — — US disclosed
US-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2023-06-29 — — US disclosed
US-10745385-B2 Covalent inhibitors of KRAS ARAXES PHARMA LLC (US) 2020-08-18 — — 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-10745385-B2 Covalent inhibitors of KRAS KRAS, NRAS, HRAS DPP4 3453/4885DPP8 3283/4885HCAR1 2987/4885
US-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF KRAS, NRAS, TP53 DPP4 2706/4885DPP8 2140/4885HCAR1 3682/4885

“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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