SCHEMBL30997652

SCHEMBL30997652

Cc1cc(Nc2ncc(C#N)c(Nc3cccc(N4CCCC4=O)n3)n2)cc2c1CNCC2

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 12/20 0.50
▸ BTK Q06187 5/20 0.41
▸ PKMYT1 Q99640 3/20 0.39
▸ SLC2A1 P11166 1/20 0.38
▸ SYK P43405 1/20 0.37
▸ MAP4K1 Q92918 1/20 0.37

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
SCHEMBL29310246 1.00 WEE1 (0.50) WEE1BTKPKMYT1SLC2A1SYK
SCHEMBL29310234 0.88 SLC2A1 (0.42) WEE1BTKPKMYT1SLC2A1SYK
SCHEMBL29310239 0.86 SLC2A1 (0.42) WEE1BTKPKMYT1SLC2A1SYK
SCHEMBL30997619 0.81 WEE1 (0.43) WEE1BTKPKMYT1SLC2A1SYK
SCHEMBL29310241 0.81 WEE1 (0.43) WEE1BTKPKMYT1SLC2A1SYK
SCHEMBL29310236 0.81 BTK (0.49) WEE1BTKPKMYT1SLC2A1SYK
SCHEMBL29310230 0.81 WEE1 (0.48) WEE1BTKSLC2A1SYK
SCHEMBL30997635 0.81 WEE1 (0.49) WEE1PKMYT1SLC2A1SYK
SCHEMBL29310208 0.81 WEE1 (0.49) WEE1PKMYT1SLC2A1SYK
SCHEMBL24773978 0.79 BTK (0.42) BTKSLC2A1SYK

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. 2024-07-11 — — 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-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF WEE1, WEE2, DCLRE1B WEE1 1/4885BTK 2297/4885PKMYT1 1740/4885

“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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