SCHEMBL25522650

SCHEMBL25522650

CC(=O)N1CCC(Nc2ncc3c(-c4ccc5nccnc5c4)c[nH]c3n2)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAP3K11 Q16584 1/20 0.44
▸ DYRK1A Q13627 2/20 0.43
▸ JAK1 P23458 1/20 0.43
▸ DYRK1B Q9Y463 1/20 0.43
▸ JAK3 P52333 4/20 0.43
▸ JAK2 O60674 2/20 0.43
▸ MAPK8 P45983 10/20 0.42
▸ MAPK9 P45984 10/20 0.42
▸ JUN P05412 9/20 0.42
▸ CDK2 P24941 9/20 0.42
▸ MAPK10 P53779 6/20 0.42
▸ CLK2 P49760 1/20 0.42
▸ CLK3 P49761 1/20 0.42
▸ FLT3 P36888 1/20 0.41
▸ CDK1 P06493 1/20 0.41
▸ CDK4 P11802 1/20 0.41
▸ CCND1 P24385 1/20 0.41

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
SCHEMBL30347891 1.00 MAP3K11 (0.44) MAP3K11DYRK1AJAK1DYRK1BJAK3
SCHEMBL30347890 0.89 MAP3K11 (0.41) MAP3K11DYRK1ADYRK1BMAPK8MAPK9
SCHEMBL25522655 0.89 MAP3K11 (0.41) MAP3K11DYRK1ADYRK1BMAPK8MAPK9
SCHEMBL25522659 0.89 DYRK1A (0.38) MAP3K11DYRK1ADYRK1BJAK3MAPK8
SCHEMBL30348774 0.89 DYRK1A (0.38) MAP3K11DYRK1ADYRK1BJAK3MAPK8
SCHEMBL25522526 0.88 DYRK1A (0.42) MAP3K11DYRK1AJAK1DYRK1BJAK3
SCHEMBL31568822 0.88 DYRK1A (0.42) MAP3K11DYRK1AJAK1DYRK1BJAK3
SCHEMBL25201523 0.88 DYRK1A (0.55) DYRK1ADYRK1BMAPK8MAPK9JUN
SCHEMBL30349412 0.88 DYRK1A (0.55) DYRK1ADYRK1BMAPK8MAPK9JUN
SCHEMBL30346692 0.88 DYRK1A (0.40) MAP3K11DYRK1AJAK1DYRK1BJAK2

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 — — US disclosed
US-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 — — 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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK1B, DYRK2 MAP3K11 203/4885DYRK1A 1/4885JAK1 988/4885

“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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