SCHEMBL29310210

SCHEMBL29310210

COCc1cc(Nc2ncc(C#N)c(Nc3cccc(N4CCCC4=O)n3)n2)ccc1C1CCN(C)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 4/20 0.42
▸ PKMYT1 Q99640 2/20 0.40
▸ LRRK2 Q5S007 1/20 0.40
▸ TNK2 Q07912 1/20 0.39
▸ SYK P43405 1/20 0.39
▸ JAK2 O60674 3/20 0.38
▸ SLC2A1 P11166 2/20 0.38
▸ TBK1 Q9UHD2 1/20 0.38
▸ MAP4K1 Q92918 2/20 0.37
▸ ULK1 O75385 2/20 0.37
▸ ULK2 Q8IYT8 2/20 0.37
▸ ALK Q9UM73 1/20 0.37
▸ CDK1 P06493 1/20 0.36
▸ KDR P35968 1/20 0.36

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
SCHEMBL30997676 1.00 WEE1 (0.42) WEE1PKMYT1LRRK2TNK2SYK
SCHEMBL30997635 0.89 WEE1 (0.49) WEE1PKMYT1TNK2SYKJAK2
SCHEMBL29310208 0.89 WEE1 (0.49) WEE1PKMYT1TNK2SYKJAK2
SCHEMBL30997621 0.89 PKMYT1 (0.49) WEE1PKMYT1LRRK2TNK2SYK
SCHEMBL29310217 0.89 PKMYT1 (0.49) WEE1PKMYT1LRRK2TNK2SYK
SCHEMBL29310236 0.82 BTK (0.49) WEE1PKMYT1TNK2SYKSLC2A1
SCHEMBL29310230 0.82 WEE1 (0.48) WEE1TNK2SYKSLC2A1ULK1
SCHEMBL30997622 0.80 SLC2A1 (0.57) WEE1PKMYT1LRRK2TNK2JAK2
SCHEMBL29310117 0.80 SLC2A1 (0.57) WEE1PKMYT1LRRK2TNK2JAK2
SCHEMBL30997606 0.80 MAP4K1 (0.39) WEE1LRRK2SYKSLC2A1TBK1

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-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. 2024-07-11 — — US disclosed
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 1/4885PKMYT1 1740/4885LRRK2 1650/4885

“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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