SCHEMBL30827633

SCHEMBL30827633

Cc1cnc(N[C@H]2CC[C@H](Nc3ccc(-n4c(=O)n(C)c5ccc(C#N)nc54)cn3)C2)nn1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.41
PCSK9 Q8NBP7 4/20 0.36
PDE4B Q07343 1/20 0.35
PDE4D Q08499 1/20 0.35
ADORA1 P30542 5/20 0.34
CCR6 P51684 2/20 0.34
GSK3B P49841 1/20 0.33
MAP4K1 Q92918 1/20 0.33
CCNK O75909 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CDK12 Q9NYV4 1/20 0.33
PRKDC P78527 3/20 0.32
USP14 P54578 1/20 0.32
PIK3CA P42336 1/20 0.31
MTOR P42345 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
SCHEMBL27251709 1.00 ADORA2A (0.41) ADORA2APCSK9PDE4BPDE4DADORA1
SCHEMBL29315308 0.90 ADORA2A (0.36) ADORA2APCSK9PDE4BPDE4DADORA1
SCHEMBL27251741 0.85 ADORA2A (0.39) ADORA2APCSK9ADORA1CCR6CCNK
SCHEMBL30827696 0.85 ADORA2A (0.39) ADORA2APCSK9ADORA1CCR6CCNK
SCHEMBL27251706 0.84 PRKDC (0.40) ADORA2APCSK9CCR6CCNKCCNA2
SCHEMBL27251707 0.84 PRKDC (0.40) ADORA2APCSK9ADORA1CCR6CCNK
SCHEMBL31063933 0.84 PRKDC (0.40) ADORA2APCSK9ADORA1CCR6CCNK
SCHEMBL31063879 0.84 PRKDC (0.40) ADORA2APCSK9CCR6CCNKCCNA2
SCHEMBL30827663 0.84 ADORA2A (0.42) ADORA2APCSK9PDE4BPDE4DADORA1
SCHEMBL27251708 0.84 ADORA2A (0.42) ADORA2APCSK9PDE4BPDE4DADORA1

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
EP-4590397-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF Astrazeneca AB (SE) 2025-07-30 EP disclosed
US-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2024-07-11 US disclosed
WO-2024062090-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2024-03-28 WO 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-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF PCSK9, PCSK7, PCSK6 ADORA2A 1546/4885PCSK9 1/4885PDE4B 1540/4885

“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.