SCHEMBL31276752

SCHEMBL31276752

CN1CCC(n2cc(-c3ccc(B4OC(C)(C)C(C)(C)O4)cc3)cn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 12/20 0.44
GSK3B P49841 7/20 0.44
WNT1 P04628 3/20 0.44
LPL P06858 5/20 0.43
LIPG Q9Y5X9 5/20 0.43
CLK2 P49760 2/20 0.41
CLK3 P49761 2/20 0.41
MET P08581 2/20 0.40
NTRK1 P04629 1/20 0.38

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
SCHEMBL17113470 0.91 LIPG (0.49) DYRK1AGSK3BWNT1LPLLIPG
SCHEMBL657486 0.85 FFAR1 (0.44) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL17113554 0.84 LPL (0.47) LPLLIPG
SCHEMBL15299291 0.79 LIPG (0.56) LPLLIPG
SCHEMBL17113549 0.78 JAK2 (0.47) LPLLIPG
SCHEMBL17129417 0.78 JAK2 (0.47) LPLLIPG
SCHEMBL21426239 0.78 FFAR1 (0.42) DYRK1AGSK3BWNT1
SCHEMBL21588639 0.77 FFAR1 (0.40) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL24643242 0.77 LIPG (0.42) LPLLIPG
SCHEMBL31276806 0.77 DYRK1A (0.47) DYRK1AGSK3BWNT1CLK2CLK3

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
EP-4712969-A1 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2026-03-25 EP disclosed
US-20240408169-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-12-12 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-20240408169-A1 CYCLIN INHIBITORS CCNI, CDK2, CDK1 DYRK1A 3674/4885GSK3B 319/4885WNT1 367/4885

“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.