SCHEMBL25637694

SCHEMBL25637694

CCN1CCc2c(cnn2C)-c2cc([N+](=O)[O-])c(OC)cc21

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ SIRT6 Q8N6T7 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ PLK1 P53350 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33
▸ PLK3 Q9H4B4 1/20 0.33
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL25637647 0.88 SIRT6 (0.39) ALDH1A1CYP2D6L3MBTL1SIRT6LMNA
SCHEMBL25637686 0.88 SIRT6 (0.34) ALDH1A1SIRT6LMNASMN1; SMN2PKM
SCHEMBL25640764 0.88 SIK2 (0.35) ALDH1A1SIRT6LMNASMN1; SMN2PKM
SCHEMBL25642368 0.86 SIRT6 (0.34) ALDH1A1CYP2D6L3MBTL1SIRT6LMNA
SCHEMBL25637702 0.85 CYP11B1 (0.36) ALDH1A1SIRT6LMNASMN1; SMN2PKM
SCHEMBL25637762 0.85 HTR2A (0.38) ALDH1A1CYP2D6L3MBTL1SIRT6LMNA
SCHEMBL25637666 0.84 TDP1 (0.40) ALDH1A1SIRT6LMNASMN1; SMN2PKM
SCHEMBL25056359 0.83 PKM (0.38) ALDH1A1SIRT6LMNASMN1; SMN2PKM
SCHEMBL25637849 0.83 SIRT6 (0.38) ALDH1A1SIRT6LMNASMN1; SMN2PKM
SCHEMBL25637760 0.83 PKM (0.38) ALDH1A1SIRT6LMNASMN1; SMN2PKM

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-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO LTD (CN) 2023-06-22 — — US disclosed
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 3656/4885CYP2D6 2883/4885L3MBTL1 4541/4885

“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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