SCHEMBL25637836

SCHEMBL25637836

COc1cc2c(cc1[N+](=O)[O-])-c1cnn(C)c1CCN2C1CCN(C)CC1F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.33
▸ ACVR1 Q04771 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ PKM P14618 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
SCHEMBL25637839 0.86 GPR119 (0.34) —
SCHEMBL25637772 0.86 SIRT6 (0.38) SIRT6ACVR1ALDH1A1LMNAMAPT
SCHEMBL25056457 0.85 CYP11B1 (0.32) ACVR1
SCHEMBL25637682 0.85 SIRT6 (0.36) SIRT6ALDH1A1LMNAMAPTTDP1
SCHEMBL25637849 0.84 SIRT6 (0.38) SIRT6ALDH1A1LMNAMAPTTDP1
SCHEMBL25637876 0.84 SIRT6 (0.34) SIRT6ALDH1A1LMNAMAPTTDP1
SCHEMBL25056275 0.81 S1PR1 (0.35) SIRT6ALDH1A1LMNAMAPTMAPK1
SCHEMBL25637845 0.81 SMN1; SMN2 (0.32) SIRT6ALDH1A1LMNA
SCHEMBL25637842 0.81 KMT2A (0.33) SIRT6ALDH1A1LMNAPKM
SCHEMBL25637830 0.80 TDP1 (0.36) SIRT6ALDH1A1LMNATDP1PKM

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 SIRT6 4278/4885ACVR1 734/4885ALDH1A1 3656/4885

“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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