SCHEMBL29310214

SCHEMBL29310214

C[C@@H]1CN(C)CCN1c1ccc(Nc2ncc(C#N)c(Nc3cccc(N4CCCC4=O)n3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 2/20 0.44
▸ JAK3 P52333 2/20 0.42
▸ WEE1 P30291 5/20 0.41
▸ TBK1 Q9UHD2 3/20 0.40
▸ JAK2 O60674 3/20 0.40
▸ FYN P06241 2/20 0.39
▸ CSF1R P07333 2/20 0.39
▸ RET P07949 2/20 0.39
▸ FGFR1 P11362 2/20 0.39
▸ FLT3 P36888 2/20 0.39
▸ CDK7 P50613 2/20 0.39
▸ CDK5 Q00535 2/20 0.39
▸ PRKAA1 Q13131 2/20 0.39
▸ PIK3CD O00329 1/20 0.39
▸ PRKAB2 O43741 1/20 0.39
▸ NUAK1 O60285 1/20 0.39
▸ CCNT1 O60563 1/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ PDGFRB P09619 1/20 0.39

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
SCHEMBL30997625 1.00 SLC2A1 (0.44) SLC2A1JAK3WEE1TBK1JAK2
SCHEMBL29310215 1.00 SLC2A1 (0.44) SLC2A1JAK3WEE1TBK1JAK2
SCHEMBL30997653 1.00 SLC2A1 (0.44) SLC2A1JAK3WEE1TBK1JAK2
SCHEMBL29310222 0.91 SLC2A1 (0.42) SLC2A1JAK3WEE1JAK2FYN
SCHEMBL29310224 0.89 SLC2A1 (0.41) SLC2A1JAK3WEE1TBK1JAK2
SCHEMBL30997622 0.88 SLC2A1 (0.57) SLC2A1JAK3WEE1JAK2FYN
SCHEMBL29310117 0.88 SLC2A1 (0.57) SLC2A1JAK3WEE1JAK2FYN
SCHEMBL30997613 0.87 SLC2A1 (0.43) SLC2A1JAK3WEE1TBK1JAK2
SCHEMBL30997675 0.87 SLC2A1 (0.43) SLC2A1JAK3WEE1TBK1JAK2
SCHEMBL29310124 0.87 SLC2A1 (0.43) SLC2A1JAK3WEE1TBK1JAK2

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 SLC2A1 4591/4885JAK3 2722/4885WEE1 1/4885

“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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