SCHEMBL30456033

SCHEMBL30456033

COc1cccc(-c2cn[nH]c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.55
AKT2 P31751 1/20 0.55
DYRK1A Q13627 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
PDE4B Q07343 1/20 0.51
ROCK2 O75116 13/20 0.51
ROCK1 Q13464 10/20 0.51
AURKA O14965 2/20 0.50
GRK2 P25098 2/20 0.50
RPS6KA1 Q15418 2/20 0.50
CYP1A1 P04798 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2E1 P05181 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C8 P10632 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2A6 P11509 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP4B1 P13584 1/20 0.50
CYP2B6 P20813 1/20 0.50

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
SCHEMBL25272757 1.00 AKT1 (0.55) AKT1AKT2DYRK1ACLK4PDE4B
Hydrochloric Acid SCHEMBL25272153 0.98 AKT1 (0.53) AKT1AKT2DYRK1ACLK4PDE4B
SCHEMBL27630914 0.88 ROCK2 (0.47) AKT1AKT2PDE4BROCK2ROCK1
SCHEMBL25424764 0.83 ROCK2 (0.62) ROCK2ROCK1
SCHEMBL30245585 0.83 ROCK2 (0.62) ROCK2ROCK1
SCHEMBL30424015 0.82 AKT2 (0.71) AKT1AKT2DYRK1ACLK4ROCK2
SCHEMBL196765 0.80 CYP3A4 (0.73) DYRK1ACLK4CYP1A1CYP1A2CYP2E1
SCHEMBL29489425 0.80 CYP3A4 (0.73) DYRK1ACLK4CYP1A1CYP1A2CYP2E1
SCHEMBL13737920 0.79 LMNA (0.50) AKT1AKT2ROCK2ROCK1CYP3A4
SCHEMBL31194828 0.78 AKT1 (0.50) AKT1AKT2ROCK2ROCK1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250288589-A1 PYRIDOPYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. 2025-09-18 US disclosed
EP-4444289-A1 PYRIDOPYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2024-10-16 EP disclosed
WO-2023107592-A1 PYRIDOPYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 WO 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-20250288589-A1 PYRIDOPYRIMIDINES AND METHODS OF THEIR USE PNPO, DPYD, PYGB AKT1 4454/4885AKT2 3690/4885DYRK1A 2379/4885

“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.