SCHEMBL23291353

SCHEMBL23291353

CN1CCN(CCC(=O)Nc2ccc(CCOC(N)=O)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.60
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA9 Q16790 1/20 0.59
LMNA P02545 3/20 0.54
MAPT P10636 2/20 0.54
ALDH1A1 P00352 2/20 0.54
NAMPT P43490 1/20 0.54
TERT O14746 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51

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
SCHEMBL23928144 0.84 TP53 (0.67) TP53CA1CA2CA9LMNA
SCHEMBL8244969 0.80 TP53 (0.72) TP53CA1CA2CA9LMNA
SCHEMBL5151404 0.79 TP53 (0.74) TP53CA1CA2CA9LMNA
SCHEMBL23291354 0.77 TP53 (0.55) TP53CA1CA2CA9LMNA
SCHEMBL15295566 0.76 TP53 (0.56) TP53CA1CA2CA9LMNA
SCHEMBL23963292 0.76 NAMPT (0.59) TP53CA1CA2CA9LMNA
SCHEMBL6491468 0.75 MAPT (0.92) TP53CA1CA2CA9LMNA
SCHEMBL6486081 0.75 TP53 (0.72) TP53CA1CA2CA9LMNA
SCHEMBL28703905 0.74 LMNA (0.44) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL28102098 0.74 NPC1 (0.49) LMNAMAPTALDH1A1SMN1; SMN2

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-11845751-B2 Triazolotriazine derivatives as A2A receptor antagonists ZHEJIANG VIMGREEN PHARMACEUTICALS, LTD. (CN) 2023-12-19 US disclosed
US-20210332055-A1 TRIAZOLOTRIAZINE DERIVATIVES AS A2A RECEPTOR ANTAGONISTS ZHEJIANG VIMGREEN PHARMACEUTICALS, LTD. (CN) 2021-10-28 US disclosed
EP-3814356-A1 TRIAZOLOTRIAZINE DERIVATIVES AS A2A RECEPTOR ANTAGONISTS Zhejiang Vimgreen Pharmaceuticals, Ltd (CN) 2021-05-05 EP 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-11845751-B2 Triazolotriazine derivatives as A2A receptor antagonists ADORA2A, ADORA1, ADORA3 TP53 2047/4885CA1 1788/4885CA2 2300/4885
US-20210332055-A1 TRIAZOLOTRIAZINE DERIVATIVES AS A2A RECEPTOR ANTAGONISTS ADORA2A, ADORA1, ADORA3 TP53 2047/4885CA1 1788/4885CA2 2300/4885

“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.