SCHEMBL25519826

SCHEMBL25519826

c1cnc2ccc(-c3c[nH]c4nc(C5CC5)ncc34)cc2c1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 10/20 0.52
▸ CLK2 P49760 2/20 0.52
▸ CLK3 P49761 2/20 0.52
▸ NPC1 O15118 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ DYRK1B Q9Y463 3/20 0.44
▸ CLK1 P49759 1/20 0.43
▸ CLK4 Q9HAZ1 1/20 0.43
▸ GSK3B P49841 1/20 0.41
▸ CAMKK1 Q8N5S9 1/20 0.41
▸ CAMKK2 Q96RR4 1/20 0.41
▸ ADORA1 P30542 1/20 0.40
▸ PDGFRB P09619 1/20 0.40
▸ PDGFRA P16234 1/20 0.40
▸ TDO2 P48775 1/20 0.40
▸ CDC7 O00311 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ BRD4 O60885 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
SCHEMBL30407682 1.00 DYRK1A (0.52) DYRK1ACLK2CLK3NPC1POLB
SCHEMBL30407226 0.96 DYRK1A (0.50) DYRK1ACLK2CLK3NPC1POLB
SCHEMBL25519827 0.96 DYRK1A (0.50) DYRK1ACLK2CLK3NPC1POLB
SCHEMBL30406336 0.87 PIM1 (0.40) DYRK1ACLK2CLK3DYRK1BCAMKK1
SCHEMBL25158399 0.87 PIM1 (0.40) DYRK1ACLK2CLK3DYRK1BCAMKK1
SCHEMBL25519950 0.84 TDO2 (0.56) DYRK1ACLK2CLK3CAMKK2TDO2
SCHEMBL30406815 0.83 CAMKK2 (0.39) DYRK1ACLK2CLK3DYRK1BCAMKK1
SCHEMBL25519881 0.83 CAMKK2 (0.39) DYRK1ACLK2CLK3DYRK1BCAMKK1
SCHEMBL26175807 0.83 DYRK1B (0.47) DYRK1ACLK2CLK3NPC1POLB
SCHEMBL25157408 0.82 DYRK1A (0.53) DYRK1ACLK2CLK3NPC1POLB

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 DYRK1A 1/4885CLK2 466/4885CLK3 1147/4885

“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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