SCHEMBL25637672

SCHEMBL25637672

CC(=O)CCc1nn(C)cc1I

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.35
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ IAPP P10997 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
SCHEMBL25637992 0.86 L3MBTL1 (0.41) ALDH1A1GAA
SCHEMBL25056416 0.80 LMNA (0.50) ALDH1A1
SCHEMBL17247576 0.76 USP2 (0.31) —
SCHEMBL15884785 0.75 IRAK4 (0.32) ATMGAA
SCHEMBL12970567 0.74 — —
SCHEMBL26388323 0.71 — —
SCHEMBL4597012 0.70 L3MBTL1 (0.49) ALDH1A1ATMGAAIAPP
SCHEMBL25056245 0.69 ALDH1A1 (0.46) ALDH1A1GAA
SCHEMBL22084126 0.69 GAA (0.37) ALDH1A1ATMGAA
SCHEMBL26388371 0.67 — —

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-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO LTD (CN) 2023-06-22 — — 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-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS EGFR, ERBB2, ERBB3 ALDH1A1 3656/4885HTR2A 3774/4885HTR2C 2282/4885

“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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